1-(3-methylcyclohexyl)pentan-1-amine

C12H25N — CID 62603972

IUPAC1-(3-methylcyclohexyl)pentan-1-amine
SMILESCCCCC(N)C1CCCC(C)C1
InChIInChI=1S/C12H25N/c1-3-4-8-12(13)11-7-5-6-10(2)9-11/h10-12H,3-9,13H2,1-2H3
InChIKeyMVWDZVDARDKEIU-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.33
Rot. Bonds4

About 1-(3-methylcyclohexyl)pentan-1-amine

1-(3-methylcyclohexyl)pentan-1-amine (PubChem CID 62603972) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is 1-(3-methylcyclohexyl)pentan-1-amine.

Molecular Properties

Compound Name1-(3-methylcyclohexyl)pentan-1-amine
PubChem CID62603972
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name1-(3-methylcyclohexyl)pentan-1-amine
SMILESCCCCC(N)C1CCCC(C)C1
InChIInChI=1S/C12H25N/c1-3-4-8-12(13)11-7-5-6-10(2)9-11/h10-12H,3-9,13H2,1-2H3
InChIKeyMVWDZVDARDKEIU-UHFFFAOYSA-N
XLogP3.33
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3-methylcyclohexyl)hexan-1-amine
CID 55210427
3-ethyl-1-(3-methylcyclohexyl)heptan-1-amine
CID 63414730
(1R)-1-cyclopentylpentan-1-amine
CID 55292231
1-(3-methylcyclopentyl)butan-1-amine
CID 65414567
3-methyl-1-(3-methylcyclohexyl)hexan-1-amine
CID 63414986
1-(3-methylcyclohexyl)pent-4-yn-1-amine
CID 63655886
1-cyclobutylnonan-1-amine
CID 64986616
3-(1-aminodecyl)cyclohexan-1-amine
CID 139824543
1-(3-methylcyclohexyl)-4-phenylbutan-1-amine
CID 55185670
(1R)-1-cyclobutylbutan-1-amine
CID 55293085
1-cycloheptylheptan-1-amine
CID 65399314
1-(3-methylcyclohexyl)but-3-yn-1-amine
CID 62233166

Frequently Asked Questions

What is the IUPAC name of 1-(3-methylcyclohexyl)pentan-1-amine?
The IUPAC name of 1-(3-methylcyclohexyl)pentan-1-amine (CID 62603972) is 1-(3-methylcyclohexyl)pentan-1-amine.
What is the SMILES notation for 1-(3-methylcyclohexyl)pentan-1-amine?
The canonical SMILES for 1-(3-methylcyclohexyl)pentan-1-amine is CCCCC(N)C1CCCC(C)C1.
What is the InChIKey of 1-(3-methylcyclohexyl)pentan-1-amine?
The InChIKey is MVWDZVDARDKEIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-3-4-8-12(13)11-7-5-6-10(2)9-11/h10-12H,3-9,13H2,1-2H3.
What are the key properties of 1-(3-methylcyclohexyl)pentan-1-amine?
1-(3-methylcyclohexyl)pentan-1-amine has a molecular weight of 183.34 g/mol, XLogP of 3.33, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylcyclohexyl)pentan-1-amine is sourced from PubChem (CID 62603972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).