cyclopentylmethanamine;3-methylbutan-1-amine;2-methylpropan-1-amine

C15H37N3 — CID 159784377

IUPACcyclopentylmethanamine;3-methylbutan-1-amine;2-methylpropan-1-amine
SMILESCC(C)CCN.CC(C)CN.NCC1CCCC1
InChIInChI=1S/C6H13N.C5H13N.C4H11N/c7-5-6-3-1-2-4-6;1-5(2)3-4-6;1-4(2)3-5/h6H,1-5,7H2;5H,3-4,6H2,1-2H3;4H,3,5H2,1-2H3
InChIKeyNHTNWVSPGAEFNZ-UHFFFAOYSA-N
MW259.48 g/mol
LogP2.73
Rot. Bonds4

About cyclopentylmethanamine;3-methylbutan-1-amine;2-methylpropan-1-amine

cyclopentylmethanamine;3-methylbutan-1-amine;2-methylpropan-1-amine (PubChem CID 159784377) has the molecular formula C15H37N3 and a molecular weight of 259.48 g/mol. Its IUPAC name is cyclopentylmethanamine;3-methylbutan-1-amine;2-methylpropan-1-amine.

Molecular Properties

Compound Namecyclopentylmethanamine;3-methylbutan-1-amine;2-methylpropan-1-amine
PubChem CID159784377
Molecular FormulaC15H37N3
Molecular Weight259.48 g/mol
Exact Mass259.30
IUPAC Namecyclopentylmethanamine;3-methylbutan-1-amine;2-methylpropan-1-amine
SMILESCC(C)CCN.CC(C)CN.NCC1CCCC1
InChIInChI=1S/C6H13N.C5H13N.C4H11N/c7-5-6-3-1-2-4-6;1-5(2)3-4-6;1-4(2)3-5/h6H,1-5,7H2;5H,3-4,6H2,1-2H3;4H,3,5H2,1-2H3
InChIKeyNHTNWVSPGAEFNZ-UHFFFAOYSA-N
XLogP2.73
TPSA78.06 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.48
LogP ≤ 52.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

cyclohexanamine;2-methylpropan-1-amine
CID 22649730
cyclohexylmethanamine;methanol
CID 70430105
cyclohexylmethanamine;hydrochloride
CID 3039618
cyclohexylmethanamine;hydrobromide
CID 13001131
(5-methylcyclononyl)methanamine
CID 91548607
cyclohexanamine;cyclohexylmethanamine
CID 174974863
4-methylpentylcyclopentane
CID 523530
N-[[4-(aminomethyl)cyclohexyl]methyl]-4-methylpentanamide
CID 114231575
3-(cyclohexylmethylsulfinyl)butan-1-amine
CID 81195369
N-[[4-(aminomethyl)cyclohexyl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine
CID 79527297
4-cyclohexyl-3-(cyclohexylmethyl)butan-1-amine
CID 173336695
(5,5-dimethylcyclononyl)methanamine
CID 129138997

Frequently Asked Questions

What is the IUPAC name of cyclopentylmethanamine;3-methylbutan-1-amine;2-methylpropan-1-amine?
The IUPAC name of cyclopentylmethanamine;3-methylbutan-1-amine;2-methylpropan-1-amine (CID 159784377) is cyclopentylmethanamine;3-methylbutan-1-amine;2-methylpropan-1-amine.
What is the SMILES notation for cyclopentylmethanamine;3-methylbutan-1-amine;2-methylpropan-1-amine?
The canonical SMILES for cyclopentylmethanamine;3-methylbutan-1-amine;2-methylpropan-1-amine is CC(C)CCN.CC(C)CN.NCC1CCCC1.
What is the InChIKey of cyclopentylmethanamine;3-methylbutan-1-amine;2-methylpropan-1-amine?
The InChIKey is NHTNWVSPGAEFNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N.C5H13N.C4H11N/c7-5-6-3-1-2-4-6;1-5(2)3-4-6;1-4(2)3-5/h6H,1-5,7H2;5H,3-4,6H2,1-2H3;4H,3,5H2,1-2H3.
What are the key properties of cyclopentylmethanamine;3-methylbutan-1-amine;2-methylpropan-1-amine?
cyclopentylmethanamine;3-methylbutan-1-amine;2-methylpropan-1-amine has a molecular weight of 259.48 g/mol, XLogP of 2.73, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentylmethanamine;3-methylbutan-1-amine;2-methylpropan-1-amine is sourced from PubChem (CID 159784377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).