N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]-N-ethylcyclohexanamine

C16H32N2 — CID 79856769

IUPACN-[1-(aminomethyl)-2,2-dimethylcyclopentyl]-N-ethylcyclohexanamine
SMILESCCN(C1CCCCC1)C1(CN)CCCC1(C)C
InChIInChI=1S/C16H32N2/c1-4-18(14-9-6-5-7-10-14)16(13-17)12-8-11-15(16,2)3/h14H,4-13,17H2,1-3H3
InChIKeyNZSFZBCDBRIWCE-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.55
Rot. Bonds4

About N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]-N-ethylcyclohexanamine

N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]-N-ethylcyclohexanamine (PubChem CID 79856769) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]-N-ethylcyclohexanamine.

Molecular Properties

Compound NameN-[1-(aminomethyl)-2,2-dimethylcyclopentyl]-N-ethylcyclohexanamine
PubChem CID79856769
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC NameN-[1-(aminomethyl)-2,2-dimethylcyclopentyl]-N-ethylcyclohexanamine
SMILESCCN(C1CCCCC1)C1(CN)CCCC1(C)C
InChIInChI=1S/C16H32N2/c1-4-18(14-9-6-5-7-10-14)16(13-17)12-8-11-15(16,2)3/h14H,4-13,17H2,1-3H3
InChIKeyNZSFZBCDBRIWCE-UHFFFAOYSA-N
XLogP3.55
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]-N-ethylcyclohexanamine 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

1-(aminomethyl)-N-cyclopropyl-N-ethyl-2,2-dimethylcyclohexan-1-amine
CID 79836655
1-(aminomethyl)-N-(cyclobutylmethyl)-N-ethyl-2,2-dimethylcyclohexan-1-amine
CID 107397761
1-(aminomethyl)-N-(cyclobutylmethyl)-N,2,2-trimethylcyclopentan-1-amine
CID 79857351
1-(aminomethyl)-N-cyclopropyl-N-ethylcyclooctan-1-amine
CID 43264050
1-(aminomethyl)-N,2,2-trimethyl-N-(2-methylcyclohexyl)cyclohexan-1-amine
CID 79847113
N-[1-(aminomethyl)-2,2-dimethylcyclohexyl]-N,1-dimethylpiperidin-3-amine
CID 79847644
N'-[1-(aminomethyl)-2,2-dimethylcyclopentyl]-N,N,N'-triethylpropane-1,3-diamine
CID 102992105
1-(aminomethyl)-N-ethyl-2,2-dimethyl-N-(2-methylpropyl)cyclohexan-1-amine
CID 79836992
1-(aminomethyl)-2,2-dimethyl-N-propan-2-yl-N-propylcyclopentan-1-amine
CID 79857560
1-(aminomethyl)-N-cyclohexyl-N-ethyl-2,4-dimethylcyclohexan-1-amine
CID 64760341
1-(aminomethyl)-N,2,2-trimethyl-N-(2-methylbutyl)cyclopentan-1-amine
CID 79858006
N-[[1-(aminomethyl)cyclopropyl]methyl]-N-ethylcyclohexanamine
CID 115453629

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]-N-ethylcyclohexanamine?
The IUPAC name of N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]-N-ethylcyclohexanamine (CID 79856769) is N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]-N-ethylcyclohexanamine.
What is the SMILES notation for N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]-N-ethylcyclohexanamine?
The canonical SMILES for N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]-N-ethylcyclohexanamine is CCN(C1CCCCC1)C1(CN)CCCC1(C)C.
What is the InChIKey of N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]-N-ethylcyclohexanamine?
The InChIKey is NZSFZBCDBRIWCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-4-18(14-9-6-5-7-10-14)16(13-17)12-8-11-15(16,2)3/h14H,4-13,17H2,1-3H3.
What are the key properties of N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]-N-ethylcyclohexanamine?
N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]-N-ethylcyclohexanamine has a molecular weight of 252.45 g/mol, XLogP of 3.55, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)-2,2-dimethylcyclopentyl]-N-ethylcyclohexanamine is sourced from PubChem (CID 79856769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).