4-cyclohexyl-N-ethylpentan-2-amine

C13H27N — CID 64718542

IUPAC4-cyclohexyl-N-ethylpentan-2-amine
SMILESCCNC(C)CC(C)C1CCCCC1
InChIInChI=1S/C13H27N/c1-4-14-12(3)10-11(2)13-8-6-5-7-9-13/h11-14H,4-10H2,1-3H3
InChIKeyJCPXSROHDVYTCI-UHFFFAOYSA-N
MW197.37 g/mol
LogP3.59
Rot. Bonds5

About 4-cyclohexyl-N-ethylpentan-2-amine

4-cyclohexyl-N-ethylpentan-2-amine (PubChem CID 64718542) has the molecular formula C13H27N and a molecular weight of 197.37 g/mol. Its IUPAC name is 4-cyclohexyl-N-ethylpentan-2-amine.

Molecular Properties

Compound Name4-cyclohexyl-N-ethylpentan-2-amine
PubChem CID64718542
Molecular FormulaC13H27N
Molecular Weight197.37 g/mol
Exact Mass197.21
IUPAC Name4-cyclohexyl-N-ethylpentan-2-amine
SMILESCCNC(C)CC(C)C1CCCCC1
InChIInChI=1S/C13H27N/c1-4-14-12(3)10-11(2)13-8-6-5-7-9-13/h11-14H,4-10H2,1-3H3
InChIKeyJCPXSROHDVYTCI-UHFFFAOYSA-N
XLogP3.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.37
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(3,5-dimethylcyclohexyl)-N-ethylpentan-2-amine
CID 64729558
4-(3,4-dimethylcyclohexyl)-N-ethylpentan-2-amine
CID 64739292
4-cyclopropyl-N-propylpentan-2-amine
CID 64721662
3-cyclohexyl-N-[(2R)-2-(ethylamino)propyl]butanamide
CID 120650989
1-cyclopentyl-N-ethylethanamine
CID 60819244
3-cyclohexyl-N-[(2R)-2-(ethylamino)propyl]butanamide;hydrochloride
CID 120650988
butan-2-ylcyclohexadecane
CID 123713671
1-cycloheptyl-N-ethyl-3-methylpentan-1-amine
CID 65399965
1-cyclohexyl-2-cyclopropyl-N-ethylpropan-1-amine
CID 114981084
butan-2-ylcyclohexane;ethane
CID 143005290
N-[(1S)-1-cyclopentylethyl]-3-(ethylamino)butanamide
CID 81391367
1-cyclohexyl-N-ethylpropan-1-amine
CID 60817829

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-N-ethylpentan-2-amine?
The IUPAC name of 4-cyclohexyl-N-ethylpentan-2-amine (CID 64718542) is 4-cyclohexyl-N-ethylpentan-2-amine.
What is the SMILES notation for 4-cyclohexyl-N-ethylpentan-2-amine?
The canonical SMILES for 4-cyclohexyl-N-ethylpentan-2-amine is CCNC(C)CC(C)C1CCCCC1.
What is the InChIKey of 4-cyclohexyl-N-ethylpentan-2-amine?
The InChIKey is JCPXSROHDVYTCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N/c1-4-14-12(3)10-11(2)13-8-6-5-7-9-13/h11-14H,4-10H2,1-3H3.
What are the key properties of 4-cyclohexyl-N-ethylpentan-2-amine?
4-cyclohexyl-N-ethylpentan-2-amine has a molecular weight of 197.37 g/mol, XLogP of 3.59, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-N-ethylpentan-2-amine is sourced from PubChem (CID 64718542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).