N-(1-cyclohexylethyl)-3-methylcyclohexan-1-amine

C15H29N — CID 43775460

IUPACN-(1-cyclohexylethyl)-3-methylcyclohexan-1-amine
SMILESCC1CCCC(NC(C)C2CCCCC2)C1
InChIInChI=1S/C15H29N/c1-12-7-6-10-15(11-12)16-13(2)14-8-4-3-5-9-14/h12-16H,3-11H2,1-2H3
InChIKeySOJUBWSTOTWDAL-UHFFFAOYSA-N
MW223.40 g/mol
LogP4.12
Rot. Bonds3

About N-(1-cyclohexylethyl)-3-methylcyclohexan-1-amine

N-(1-cyclohexylethyl)-3-methylcyclohexan-1-amine (PubChem CID 43775460) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is N-(1-cyclohexylethyl)-3-methylcyclohexan-1-amine.

Molecular Properties

Compound NameN-(1-cyclohexylethyl)-3-methylcyclohexan-1-amine
PubChem CID43775460
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC NameN-(1-cyclohexylethyl)-3-methylcyclohexan-1-amine
SMILESCC1CCCC(NC(C)C2CCCCC2)C1
InChIInChI=1S/C15H29N/c1-12-7-6-10-15(11-12)16-13(2)14-8-4-3-5-9-14/h12-16H,3-11H2,1-2H3
InChIKeySOJUBWSTOTWDAL-UHFFFAOYSA-N
XLogP4.12
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1S)-1-cyclohexylethyl]-3-methylcyclopentan-1-amine
CID 81387418
N-(1-cyclohexylethyl)-3-methylcyclobutan-1-amine
CID 115677489
N-[(1S)-1-cycloheptylethyl]cycloheptanamine
CID 81389840
1-N-[(1S)-1-cycloheptylethyl]cyclohexane-1,3-diamine
CID 81390120
N-[(1R)-1-cycloheptylethyl]-3-cyclopropylcyclohexan-1-amine
CID 81392588
N-[(1S)-1-cyclohexylethyl]-3-cyclopropylcyclohexan-1-amine
CID 81387835
N-(1-cyclopropylethyl)cyclohexanamine
CID 43177177
N-[di(cyclobutyl)methyl]-3-methylcyclohexan-1-amine
CID 112743180
N-[(1S)-1-cycloheptylethyl]-4-propan-2-ylcycloheptan-1-amine
CID 81389643
N-(1-cyclohexylethyl)-4-propan-2-ylcycloheptan-1-amine
CID 65091327
N-[(1R)-1-cyclopentylethyl]-3,4-dimethylcyclohexan-1-amine
CID 81395850
N-[(1R)-1-cyclohexylethyl]-2,4-dimethylcyclohexan-1-amine
CID 81385364

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexylethyl)-3-methylcyclohexan-1-amine?
The IUPAC name of N-(1-cyclohexylethyl)-3-methylcyclohexan-1-amine (CID 43775460) is N-(1-cyclohexylethyl)-3-methylcyclohexan-1-amine.
What is the SMILES notation for N-(1-cyclohexylethyl)-3-methylcyclohexan-1-amine?
The canonical SMILES for N-(1-cyclohexylethyl)-3-methylcyclohexan-1-amine is CC1CCCC(NC(C)C2CCCCC2)C1.
What is the InChIKey of N-(1-cyclohexylethyl)-3-methylcyclohexan-1-amine?
The InChIKey is SOJUBWSTOTWDAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-12-7-6-10-15(11-12)16-13(2)14-8-4-3-5-9-14/h12-16H,3-11H2,1-2H3.
What are the key properties of N-(1-cyclohexylethyl)-3-methylcyclohexan-1-amine?
N-(1-cyclohexylethyl)-3-methylcyclohexan-1-amine has a molecular weight of 223.40 g/mol, XLogP of 4.12, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylethyl)-3-methylcyclohexan-1-amine is sourced from PubChem (CID 43775460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).