N-(3-methylcyclopentyl)cyclohex-2-en-1-amine

C12H21N — CID 115893652

IUPACN-(3-methylcyclopentyl)cyclohex-2-en-1-amine
SMILESCC1CCC(NC2C=CCCC2)C1
InChIInChI=1S/C12H21N/c1-10-7-8-12(9-10)13-11-5-3-2-4-6-11/h3,5,10-13H,2,4,6-9H2,1H3
InChIKeyUWRFDKYXOLADIC-UHFFFAOYSA-N
MW179.31 g/mol
LogP2.87
Rot. Bonds2

About N-(3-methylcyclopentyl)cyclohex-2-en-1-amine

N-(3-methylcyclopentyl)cyclohex-2-en-1-amine (PubChem CID 115893652) has the molecular formula C12H21N and a molecular weight of 179.31 g/mol. Its IUPAC name is N-(3-methylcyclopentyl)cyclohex-2-en-1-amine.

Molecular Properties

Compound NameN-(3-methylcyclopentyl)cyclohex-2-en-1-amine
PubChem CID115893652
Molecular FormulaC12H21N
Molecular Weight179.31 g/mol
Exact Mass179.17
IUPAC NameN-(3-methylcyclopentyl)cyclohex-2-en-1-amine
SMILESCC1CCC(NC2C=CCCC2)C1
InChIInChI=1S/C12H21N/c1-10-7-8-12(9-10)13-11-5-3-2-4-6-11/h3,5,10-13H,2,4,6-9H2,1H3
InChIKeyUWRFDKYXOLADIC-UHFFFAOYSA-N
XLogP2.87
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.31
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-(3-methylcyclopentyl)cyclohex-2-en-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

N-cyclohex-2-en-1-ylcyclooctanamine
CID 103830652
N-[(3-methylcyclopentyl)methyl]cyclohex-2-en-1-amine
CID 107908398
N-(2,2,3,3-tetramethylcyclopropyl)cyclohex-2-en-1-amine
CID 107907258
N-(2,3-dimethylcyclopentyl)cyclohex-2-en-1-amine
CID 107907080
trans-(1R,3R)-3-methyl-N-[(1S,3S)-3-methylcyclohexyl]cyclohexan-1-amine
CID 99646097
N-[(1R,3R)-3-methylcyclopentyl]cyclohexanamine
CID 95376125
N-[2-(3-methylcyclohexyl)ethyl]cyclohex-2-en-1-amine
CID 107907027
4-(cyclohept-2-en-1-ylamino)-1-methylcyclohexane-1-thiol
CID 166930977
3-cyclopropyl-N-(3-methylcyclopentyl)cyclohexan-1-amine
CID 115655106
N-(1-cyclobutylethyl)cyclohex-2-en-1-amine
CID 103903529
trans-(1S,2S)-2-[[(1S,3R)-3-methylcyclopentyl]amino]cyclohexan-1-ol
CID 124677465
3-(3-methylcyclopentyl)cycloheptene
CID 163966281

Frequently Asked Questions

What is the IUPAC name of N-(3-methylcyclopentyl)cyclohex-2-en-1-amine?
The IUPAC name of N-(3-methylcyclopentyl)cyclohex-2-en-1-amine (CID 115893652) is N-(3-methylcyclopentyl)cyclohex-2-en-1-amine.
What is the SMILES notation for N-(3-methylcyclopentyl)cyclohex-2-en-1-amine?
The canonical SMILES for N-(3-methylcyclopentyl)cyclohex-2-en-1-amine is CC1CCC(NC2C=CCCC2)C1.
What is the InChIKey of N-(3-methylcyclopentyl)cyclohex-2-en-1-amine?
The InChIKey is UWRFDKYXOLADIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N/c1-10-7-8-12(9-10)13-11-5-3-2-4-6-11/h3,5,10-13H,2,4,6-9H2,1H3.
What are the key properties of N-(3-methylcyclopentyl)cyclohex-2-en-1-amine?
N-(3-methylcyclopentyl)cyclohex-2-en-1-amine has a molecular weight of 179.31 g/mol, XLogP of 2.87, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylcyclopentyl)cyclohex-2-en-1-amine is sourced from PubChem (CID 115893652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).