1-cyclohexyl-3-ethylpentan-1-amine

C13H27N — CID 82920637

IUPAC1-cyclohexyl-3-ethylpentan-1-amine
SMILESCCC(CC)CC(N)C1CCCCC1
InChIInChI=1S/C13H27N/c1-3-11(4-2)10-13(14)12-8-6-5-7-9-12/h11-13H,3-10,14H2,1-2H3
InChIKeyHJCDPTIDHMAUJV-UHFFFAOYSA-N
MW197.37 g/mol
LogP3.72
Rot. Bonds5

About 1-cyclohexyl-3-ethylpentan-1-amine

1-cyclohexyl-3-ethylpentan-1-amine (PubChem CID 82920637) has the molecular formula C13H27N and a molecular weight of 197.37 g/mol. Its IUPAC name is 1-cyclohexyl-3-ethylpentan-1-amine.

Molecular Properties

Compound Name1-cyclohexyl-3-ethylpentan-1-amine
PubChem CID82920637
Molecular FormulaC13H27N
Molecular Weight197.37 g/mol
Exact Mass197.21
IUPAC Name1-cyclohexyl-3-ethylpentan-1-amine
SMILESCCC(CC)CC(N)C1CCCCC1
InChIInChI=1S/C13H27N/c1-3-11(4-2)10-13(14)12-8-6-5-7-9-12/h11-13H,3-10,14H2,1-2H3
InChIKeyHJCDPTIDHMAUJV-UHFFFAOYSA-N
XLogP3.72
TPSA26.02 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 ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R,4R)-4-amino-4-cyclohexylbutan-2-ol
CID 131096382
1-cyclohexyl-3,4,4-trimethylpentan-1-amine
CID 114981190
1-cyclobutyl-4-ethylhexan-2-amine
CID 103169365
2-cyclohexylpentan-3-amine
CID 79308576
1-cyclohexyl-4-methoxy-3-methylbutan-1-amine
CID 105079501
1-cyclohexyl-5-ethylheptan-3-amine
CID 105028019
(1-bromo-4-ethylhexan-2-yl)cyclopentane
CID 112570638
3-ethyl-1-(3-methylcyclohexyl)heptan-1-amine
CID 63414730
1-amino-1-cyclohexyl-6-methylheptan-3-ol
CID 22367824
(1S)-1,2-dicyclohexylethanamine
CID 44574818
2-cycloheptyl-1-cyclopentylethanamine
CID 115779065
1-cycloheptylheptan-1-amine
CID 65399314

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-3-ethylpentan-1-amine?
The IUPAC name of 1-cyclohexyl-3-ethylpentan-1-amine (CID 82920637) is 1-cyclohexyl-3-ethylpentan-1-amine.
What is the SMILES notation for 1-cyclohexyl-3-ethylpentan-1-amine?
The canonical SMILES for 1-cyclohexyl-3-ethylpentan-1-amine is CCC(CC)CC(N)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-3-ethylpentan-1-amine?
The InChIKey is HJCDPTIDHMAUJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N/c1-3-11(4-2)10-13(14)12-8-6-5-7-9-12/h11-13H,3-10,14H2,1-2H3.
What are the key properties of 1-cyclohexyl-3-ethylpentan-1-amine?
1-cyclohexyl-3-ethylpentan-1-amine has a molecular weight of 197.37 g/mol, XLogP of 3.72, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-3-ethylpentan-1-amine is sourced from PubChem (CID 82920637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).