chempirical

1-(1-Methylpropyl)piperazine

C8H18N2CAS 34581-21-0142.25 g/mol

Open in Covalent MOL file
NNH
Secondary amineTertiary amine

Properties

Molecular formula
C8H18N2
Molar mass
142.25 g/mol
Exact mass
142.1470 Da
logP
0.69Crippen estimate
Polar surface area
15.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
2

Identifiers

CAS number
34581-21-0
SMILES
CCC(C)N1CCNCC1
InChIKey
ZHHCLIRTNOSAPB-UHFFFAOYSA-N
InChI
InChI=1S/C8H18N2/c1-3-8(2)10-6-4-9-5-7-10/h8-9H,3-7H2,1-2H3

Weigh it out

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

Names and synonyms

4 names
  • Piperazine, 1-(1-methylpropyl)-
  • 1-sec-Butylpiperazine
  • 1-Butan-2-ylpiperazine
  • 1-(2-Butyl)-piperazine

Work with 1-(1-Methylpropyl)piperazine

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

Similar compounds

Isopropylpiperazine4318-42-752 % similar 1-(1-Methyl-4-piperidinyl)piperazine23995-88-240 % similar 1-(Oxetan-3-yl)piperazine1254115-23-539 % similar 1-Cyclohexylpiperazine17766-28-839 % similar 1-(1-Phenylethyl)piperazine69628-75-738 % similar 1-Ethylpiperazine5308-25-837 % similar Methylpiperazine109-01-335 % similar 4-(1-Pyrrolidinyl)piperidine5004-07-934 % similar

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

Same formula

1-(1-Methylethyl)-4-piperidinamine127285-08-9 2-(1-Methylpiperidin-4-yl)ethanamine20845-38-9 1,4-Cyclohexanedimethanamine2549-93-1 1,3-Bac2579-20-6 1-Piperidinepropanamine3529-08-6 N1,N1,N4,N4-Tetramethyl-2-butene-1,4-diamine4559-79-9 1,4-Diethylpiperazine6483-50-7 trans-N,N′-Dimethyl-1,2-cyclohexanediamine67579-81-1

Elsewhere

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