1-Cyclopropylpiperazine

C₇H₁₄N₂CAS 20327-23-5126.20 g/mol

Open in Covalent MOL file

Secondary amine Tertiary amine

Properties

Molecular formula: C₇H₁₄N₂
Molar mass: 126.20 g/mol
Exact mass: 126.1157 Da
logP: 0.05Crippen estimate
Polar surface area: 15.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed60% of notifiers
H312 Harmful in contact with skin20% of notifiers
H314 Causes severe skin burns and eye damage40% of notifiers
H315 Causes skin irritation40% of notifiers
H318 Causes serious eye damage20% of notifiers
H319 Causes serious eye irritation40% of notifiers
H332 Harmful if inhaled20% of notifiers
H335 May cause respiratory irritation40% of notifiers

Aggregated from 5 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, P501

Identifiers

CAS number

20327-23-5

SMILES

C1CC1N2CCNCC2

InChIKey

HNZJIWIXRPBFAN-UHFFFAOYSA-N

InChI

InChI=1S/C7H14N2/c1-2-7(1)9-5-3-8-4-6-9/h7-8H,1-6H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 1-Cyclopropylpiperazine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

1-Cyclopropylpiperazine dihydrochloride139256-79-4Salt

Similar compounds

1-Cyclopentylpiperazine21043-40-378 % similar 1-Cyclohexylpiperazine17766-28-874 % similar 1-Cycloheptylpiperazine21043-42-574 % similar 1-Cyclooctylpiperazine21043-43-674 % similar 4-(1-Pyrrolidinyl)piperidine5004-07-965 % similar 1-(1-Methyl-4-piperidinyl)piperazine23995-88-264 % similar 1,4′-Bipiperidine4897-50-162 % similar 1-(Oxetan-3-yl)piperazine1254115-23-557 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-Methyl-1H-hexahydropyrrolo[3,4-B]pyrrole132414-59-6 1-Allylpiperazine13961-36-9 (4aS,7aS)-Octahydro-1H-pyrrolo[3,4-b]pyridine151213-40-0 (4aR,7aR)-Octahydro-1H-pyrrolo[3,4-b]pyridine151213-42-2 3-[(1,1-Dimethylethyl)amino]propanenitrile21539-53-7 1,4-Diazobicylco[3.2.2]nonane283-38-5 N-Amino-3-azabicyclo[3.3.0]octane54528-00-6 N,N′-Diisopropylcarbodiimide693-13-0

Elsewhere

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