Cyclobutanemethanamine

C₅H₁₁NCAS 4415-83-285.15 g/mol

Open in Covalent MOL file

Primary amine

Properties

Molecular formula: C₅H₁₁N
Molar mass: 85.15 g/mol
Exact mass: 85.0891 Da
logP: 0.75Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Hazards

Danger

H225 Highly Flammable liquid and vapor50% of notifiers
H302 Harmful if swallowed33.3% of notifiers
H314 Causes severe skin burns and eye damage50% of notifiers
H318 Causes serious eye damage16.7% of notifiers

Aggregated from 6 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P260, P264, P264+P265, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P363, P370+P378, P403+P235, P405, P501

Identifiers

CAS number

4415-83-2

SMILES

NCC1CCC1

InChIKey

LQNHRNOPWKZUSN-UHFFFAOYSA-N

InChI

InChI=1S/C5H11N/c6-4-5-2-1-3-5/h5H,1-4,6H2

Weigh it out

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

Names and synonyms

6 names

Cyclobutanemethylamine
Cyclobutylmethylamine
(Aminomethyl)cyclobutane
Cyclobutylmethaneamine
Cyclobutylmethanamine
1-Cyclobutylmethanamine

Work with Cyclobutanemethanamine

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.

Cyclobutylmethylamine hydrochloride5454-82-0Salt

Similar compounds

Cyclohexanemethanamine3218-02-880 % similar 1,3-BAC2579-20-675 % similar Cyclopropanemethanamine2516-47-471 % similar 1,4-Cyclohexanedimethanamine2549-93-171 % similar Aminomethylcyclopentane hydrochloride58714-85-571 % similar 2-n-Octyl-1-dodecylamine62281-06-557 % similar 4-Aminomethyltetrahydropyran130290-79-853 % similar 4-(Aminomethyl)piperidine7144-05-053 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Cyclopentylamine1003-03-8 Piperidine110-89-4 1-Methylpyrrolidine120-94-5 N,N-Dimethylallylamine2155-94-4 (2R)-2-Methylpyrrolidine41720-98-3 (2S)-2-Methylpyrrolidine59335-84-1 2-Methylpyrrolidine765-38-8

Elsewhere

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