N-[(1R)-1-cyclopentylethyl]-3,4-dimethylcyclohexan-1-amine

C15H29N — CID 81395850

IUPACN-[(1R)-1-cyclopentylethyl]-3,4-dimethylcyclohexan-1-amine
SMILESCC1CCC(N[C@H](C)C2CCCC2)CC1C
InChIInChI=1S/C15H29N/c1-11-8-9-15(10-12(11)2)16-13(3)14-6-4-5-7-14/h11-16H,4-10H2,1-3H3/t11?,12?,13-,15?/m1/s1
InChIKeyHTNYTMIVHIZHKM-PYYBWGNESA-N
MW223.40 g/mol
LogP3.98
Rot. Bonds3

About N-[(1R)-1-cyclopentylethyl]-3,4-dimethylcyclohexan-1-amine

N-[(1R)-1-cyclopentylethyl]-3,4-dimethylcyclohexan-1-amine (PubChem CID 81395850) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is N-[(1R)-1-cyclopentylethyl]-3,4-dimethylcyclohexan-1-amine.

Molecular Properties

Compound NameN-[(1R)-1-cyclopentylethyl]-3,4-dimethylcyclohexan-1-amine
PubChem CID81395850
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC NameN-[(1R)-1-cyclopentylethyl]-3,4-dimethylcyclohexan-1-amine
SMILESCC1CCC(N[C@H](C)C2CCCC2)CC1C
InChIInChI=1S/C15H29N/c1-11-8-9-15(10-12(11)2)16-13(3)14-6-4-5-7-14/h11-16H,4-10H2,1-3H3/t11?,12?,13-,15?/m1/s1
InChIKeyHTNYTMIVHIZHKM-PYYBWGNESA-N
XLogP3.98
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 ≤ 53.98
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-(1-cyclohexylethyl)-3-methylcyclohexan-1-amine
CID 43775460
3-N-(1-cyclohexylethyl)cyclopentane-1,3-diamine
CID 79461481
N-[(1S)-1-cycloheptylethyl]cycloheptanamine
CID 81389840
N-[(1R)-1-cyclopentylethyl]-3-ethylcyclopentan-1-amine
CID 81395536
N-[(1R)-1-cyclopropylethyl]cyclopropanamine
CID 28819115
N-[(1R)-1-cycloheptylethyl]-4-propan-2-ylcyclohexan-1-amine
CID 81393268
N-(1-cyclohexylethyl)-4-propan-2-ylcyclohexan-1-amine
CID 63478862
N-(1-cyclopropylethyl)cyclohexanamine
CID 43177177
N-[(1S)-1-cyclobutylethyl]-2-methylcyclobutan-1-amine
CID 130662747
N-(1-cyclopentylethyl)-2-methylcyclohexan-1-amine
CID 62631533

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-cyclopentylethyl]-3,4-dimethylcyclohexan-1-amine?
The IUPAC name of N-[(1R)-1-cyclopentylethyl]-3,4-dimethylcyclohexan-1-amine (CID 81395850) is N-[(1R)-1-cyclopentylethyl]-3,4-dimethylcyclohexan-1-amine.
What is the SMILES notation for N-[(1R)-1-cyclopentylethyl]-3,4-dimethylcyclohexan-1-amine?
The canonical SMILES for N-[(1R)-1-cyclopentylethyl]-3,4-dimethylcyclohexan-1-amine is CC1CCC(N[C@H](C)C2CCCC2)CC1C.
What is the InChIKey of N-[(1R)-1-cyclopentylethyl]-3,4-dimethylcyclohexan-1-amine?
The InChIKey is HTNYTMIVHIZHKM-PYYBWGNESA-N. The full InChI is InChI=1S/C15H29N/c1-11-8-9-15(10-12(11)2)16-13(3)14-6-4-5-7-14/h11-16H,4-10H2,1-3H3/t11?,12?,13-,15?/m1/s1.
What are the key properties of N-[(1R)-1-cyclopentylethyl]-3,4-dimethylcyclohexan-1-amine?
N-[(1R)-1-cyclopentylethyl]-3,4-dimethylcyclohexan-1-amine has a molecular weight of 223.40 g/mol, XLogP of 3.98, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-cyclopentylethyl]-3,4-dimethylcyclohexan-1-amine is sourced from PubChem (CID 81395850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).