1-[1-(2-methylpropyl)cyclopentyl]hexan-1-amine

C15H31N — CID 115837142

IUPAC1-[1-(2-methylpropyl)cyclopentyl]hexan-1-amine
SMILESCCCCCC(N)C1(CC(C)C)CCCC1
InChIInChI=1S/C15H31N/c1-4-5-6-9-14(16)15(12-13(2)3)10-7-8-11-15/h13-14H,4-12,16H2,1-3H3
InChIKeyBLYJBXIEZBENNZ-UHFFFAOYSA-N
MW225.42 g/mol
LogP4.50
Rot. Bonds7

About 1-[1-(2-methylpropyl)cyclopentyl]hexan-1-amine

1-[1-(2-methylpropyl)cyclopentyl]hexan-1-amine (PubChem CID 115837142) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is 1-[1-(2-methylpropyl)cyclopentyl]hexan-1-amine.

Molecular Properties

Compound Name1-[1-(2-methylpropyl)cyclopentyl]hexan-1-amine
PubChem CID115837142
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC Name1-[1-(2-methylpropyl)cyclopentyl]hexan-1-amine
SMILESCCCCCC(N)C1(CC(C)C)CCCC1
InChIInChI=1S/C15H31N/c1-4-5-6-9-14(16)15(12-13(2)3)10-7-8-11-15/h13-14H,4-12,16H2,1-3H3
InChIKeyBLYJBXIEZBENNZ-UHFFFAOYSA-N
XLogP4.50
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.42
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-[1-(2-methylpropyl)cyclopentyl]hexan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-methyl-1-[1-(2-methylpropyl)cyclopentyl]butan-1-amine
CID 115782159
1-[1-(2-methylpropyl)cyclopentyl]-N-propylheptan-1-amine
CID 115833191
4-methoxy-4-methyl-1-[1-(2-methylpropyl)cyclopentyl]pentan-1-amine
CID 103032089
1-(1-methoxycyclopentyl)hexan-1-amine
CID 104610613
1-(1-methoxycyclopentyl)heptan-1-amine
CID 104610578
1-[1-(2-methylpropyl)cyclopentyl]-2-propan-2-yloxyethanamine
CID 105013085
1-(1-methoxycycloheptyl)hexan-1-amine
CID 116769766
1-(1-methoxycyclohexyl)undecan-1-amine
CID 116762708
1-(1-aminooctyl)-N,N-dimethylcyclopentan-1-amine
CID 79067548
1-(1-piperidin-1-ylcyclopentyl)heptan-1-amine
CID 79057989
1-(1-phenylcyclohexyl)octan-1-amine
CID 63417810
1-(2-methylthiolan-2-yl)hexan-1-amine
CID 105129649

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-methylpropyl)cyclopentyl]hexan-1-amine?
The IUPAC name of 1-[1-(2-methylpropyl)cyclopentyl]hexan-1-amine (CID 115837142) is 1-[1-(2-methylpropyl)cyclopentyl]hexan-1-amine.
What is the SMILES notation for 1-[1-(2-methylpropyl)cyclopentyl]hexan-1-amine?
The canonical SMILES for 1-[1-(2-methylpropyl)cyclopentyl]hexan-1-amine is CCCCCC(N)C1(CC(C)C)CCCC1.
What is the InChIKey of 1-[1-(2-methylpropyl)cyclopentyl]hexan-1-amine?
The InChIKey is BLYJBXIEZBENNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N/c1-4-5-6-9-14(16)15(12-13(2)3)10-7-8-11-15/h13-14H,4-12,16H2,1-3H3.
What are the key properties of 1-[1-(2-methylpropyl)cyclopentyl]hexan-1-amine?
1-[1-(2-methylpropyl)cyclopentyl]hexan-1-amine has a molecular weight of 225.42 g/mol, XLogP of 4.50, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-methylpropyl)cyclopentyl]hexan-1-amine is sourced from PubChem (CID 115837142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).