N-methyl-1-(2-methylcyclopentyl)hex-5-en-1-amine

C13H25N — CID 107189131

IUPACN-methyl-1-(2-methylcyclopentyl)hex-5-en-1-amine
SMILESC=CCCCC(NC)C1CCCC1C
InChIInChI=1S/C13H25N/c1-4-5-6-10-13(14-3)12-9-7-8-11(12)2/h4,11-14H,1,5-10H2,2-3H3
InChIKeyXUJNRFCHHUZJCH-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.37
Rot. Bonds6

About N-methyl-1-(2-methylcyclopentyl)hex-5-en-1-amine

N-methyl-1-(2-methylcyclopentyl)hex-5-en-1-amine (PubChem CID 107189131) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is N-methyl-1-(2-methylcyclopentyl)hex-5-en-1-amine.

Molecular Properties

Compound NameN-methyl-1-(2-methylcyclopentyl)hex-5-en-1-amine
PubChem CID107189131
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC NameN-methyl-1-(2-methylcyclopentyl)hex-5-en-1-amine
SMILESC=CCCCC(NC)C1CCCC1C
InChIInChI=1S/C13H25N/c1-4-5-6-10-13(14-3)12-9-7-8-11(12)2/h4,11-14H,1,5-10H2,2-3H3
InChIKeyXUJNRFCHHUZJCH-UHFFFAOYSA-N
XLogP3.37
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-methyl-1-(2-methylcyclopentyl)hex-5-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,4,4-trimethyl-1-(2-methylcyclopentyl)pentan-1-amine
CID 107188477
2-cyclohexyl-N-methyl-1-(2-methylcyclopentyl)ethanamine
CID 107188288
1-cyclohexyl-N-methyloct-7-en-1-amine
CID 107008890
N-methyl-1-(oxolan-2-yl)hex-5-en-1-amine
CID 65328746
1-(3-ethylcyclohexyl)-N-methylhex-5-en-1-amine
CID 65414544
3-ethyl-N-methyl-1-(2-methylcyclopentyl)heptan-1-amine
CID 107187935
1-[2-(trifluoromethyl)cyclohexyl]hex-5-enylhydrazine
CID 105311422
1-(4-butylcyclohexyl)-N-methylhex-5-en-1-amine
CID 104986932
N-methyl-1-(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)hex-5-en-1-amine
CID 105153267
1-(2,3-dihydro-1-benzothiophen-3-yl)-N-methylhex-5-en-1-amine
CID 105152995
N-methyl-1-(2-methylcyclopentyl)-3-thiophen-2-ylpropan-1-amine
CID 107188935
1-(2,2-dimethylcyclohexyl)-N-ethylhex-5-en-1-amine
CID 107189124

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methylcyclopentyl)hex-5-en-1-amine?
The IUPAC name of N-methyl-1-(2-methylcyclopentyl)hex-5-en-1-amine (CID 107189131) is N-methyl-1-(2-methylcyclopentyl)hex-5-en-1-amine.
What is the SMILES notation for N-methyl-1-(2-methylcyclopentyl)hex-5-en-1-amine?
The canonical SMILES for N-methyl-1-(2-methylcyclopentyl)hex-5-en-1-amine is C=CCCCC(NC)C1CCCC1C.
What is the InChIKey of N-methyl-1-(2-methylcyclopentyl)hex-5-en-1-amine?
The InChIKey is XUJNRFCHHUZJCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-4-5-6-10-13(14-3)12-9-7-8-11(12)2/h4,11-14H,1,5-10H2,2-3H3.
What are the key properties of N-methyl-1-(2-methylcyclopentyl)hex-5-en-1-amine?
N-methyl-1-(2-methylcyclopentyl)hex-5-en-1-amine has a molecular weight of 195.35 g/mol, XLogP of 3.37, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methylcyclopentyl)hex-5-en-1-amine is sourced from PubChem (CID 107189131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).