4,4-dimethyl-N-(2-methylcyclohexyl)cycloheptan-1-amine

C16H31N — CID 65082506

IUPAC4,4-dimethyl-N-(2-methylcyclohexyl)cycloheptan-1-amine
SMILESCC1CCCCC1NC1CCCC(C)(C)CC1
InChIInChI=1S/C16H31N/c1-13-7-4-5-9-15(13)17-14-8-6-11-16(2,3)12-10-14/h13-15,17H,4-12H2,1-3H3
InChIKeyNCEIZANGRWPOFL-UHFFFAOYSA-N
MW237.43 g/mol
LogP4.51
Rot. Bonds2

About 4,4-dimethyl-N-(2-methylcyclohexyl)cycloheptan-1-amine

4,4-dimethyl-N-(2-methylcyclohexyl)cycloheptan-1-amine (PubChem CID 65082506) has the molecular formula C16H31N and a molecular weight of 237.43 g/mol. Its IUPAC name is 4,4-dimethyl-N-(2-methylcyclohexyl)cycloheptan-1-amine.

Molecular Properties

Compound Name4,4-dimethyl-N-(2-methylcyclohexyl)cycloheptan-1-amine
PubChem CID65082506
Molecular FormulaC16H31N
Molecular Weight237.43 g/mol
Exact Mass237.25
IUPAC Name4,4-dimethyl-N-(2-methylcyclohexyl)cycloheptan-1-amine
SMILESCC1CCCCC1NC1CCCC(C)(C)CC1
InChIInChI=1S/C16H31N/c1-13-7-4-5-9-15(13)17-14-8-6-11-16(2,3)12-10-14/h13-15,17H,4-12H2,1-3H3
InChIKeyNCEIZANGRWPOFL-UHFFFAOYSA-N
XLogP4.51
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.43
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4,4-dimethyl-N-(2-methylcyclohexyl)cycloheptan-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-(2,3-dimethylcyclohexyl)-4,4-dimethylcycloheptan-1-amine
CID 65082404
2-[(4,4-dimethylcycloheptyl)amino]cyclohexan-1-ol
CID 65083758
cis-(1R,2S)-N-cyclopropyl-2-methylcyclohexan-1-amine
CID 30048017
N-(2-methylcyclohexyl)-1,4-dioxaspiro[4.5]decan-8-amine
CID 43194980
N-(3,3-dimethylcyclopentyl)-2,3-dimethylcyclohexan-1-amine
CID 80693580
cis-(1S,2R)-2-methyl-N-[(1S,2R)-2-methylcyclopentyl]cyclohexan-1-amine
CID 124708997
N-(2,4,4-trimethylcyclopentyl)cyclohexanamine
CID 106661501
2-methyl-N-(2,4,4-trimethylcyclopentyl)cyclohexan-1-amine
CID 106661603
2-methyl-N-(3-methylcyclobutyl)cycloheptan-1-amine
CID 104859847
N-(3,3-dimethylcyclopentyl)cyclododecanamine
CID 114544295
4,4-difluoro-N-(2-methylcyclobutyl)cyclohexan-1-amine
CID 130677278
3,4-dimethyl-N-(2-methylcyclohexyl)cyclohexan-1-amine
CID 64731982

Frequently Asked Questions

What is the IUPAC name of 4,4-dimethyl-N-(2-methylcyclohexyl)cycloheptan-1-amine?
The IUPAC name of 4,4-dimethyl-N-(2-methylcyclohexyl)cycloheptan-1-amine (CID 65082506) is 4,4-dimethyl-N-(2-methylcyclohexyl)cycloheptan-1-amine.
What is the SMILES notation for 4,4-dimethyl-N-(2-methylcyclohexyl)cycloheptan-1-amine?
The canonical SMILES for 4,4-dimethyl-N-(2-methylcyclohexyl)cycloheptan-1-amine is CC1CCCCC1NC1CCCC(C)(C)CC1.
What is the InChIKey of 4,4-dimethyl-N-(2-methylcyclohexyl)cycloheptan-1-amine?
The InChIKey is NCEIZANGRWPOFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N/c1-13-7-4-5-9-15(13)17-14-8-6-11-16(2,3)12-10-14/h13-15,17H,4-12H2,1-3H3.
What are the key properties of 4,4-dimethyl-N-(2-methylcyclohexyl)cycloheptan-1-amine?
4,4-dimethyl-N-(2-methylcyclohexyl)cycloheptan-1-amine has a molecular weight of 237.43 g/mol, XLogP of 4.51, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dimethyl-N-(2-methylcyclohexyl)cycloheptan-1-amine is sourced from PubChem (CID 65082506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).