1-(cyclohexen-1-yl)butan-1-amine

C10H19N — CID 62079375

IUPAC1-(cyclohexen-1-yl)butan-1-amine
SMILESCCCC(N)C1=CCCCC1
InChIInChI=1S/C10H19N/c1-2-6-10(11)9-7-4-3-5-8-9/h7,10H,2-6,8,11H2,1H3
InChIKeyUXWPEJYSZQECHA-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.61
Rot. Bonds3

About 1-(cyclohexen-1-yl)butan-1-amine

1-(cyclohexen-1-yl)butan-1-amine (PubChem CID 62079375) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 1-(cyclohexen-1-yl)butan-1-amine.

Molecular Properties

Compound Name1-(cyclohexen-1-yl)butan-1-amine
PubChem CID62079375
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name1-(cyclohexen-1-yl)butan-1-amine
SMILESCCCC(N)C1=CCCCC1
InChIInChI=1S/C10H19N/c1-2-6-10(11)9-7-4-3-5-8-9/h7,10H,2-6,8,11H2,1H3
InChIKeyUXWPEJYSZQECHA-UHFFFAOYSA-N
XLogP2.61
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-(cyclohepten-1-yl)heptan-1-amine
CID 114752507
1-(cyclopenten-1-yl)pentan-1-amine
CID 62078864
1-(cyclohepten-1-yl)-3-methoxypropan-1-amine
CID 106652645
(1R)-1-(cyclopenten-1-yl)propan-1-amine
CID 82763490
1-(cyclohepten-1-yl)-4-ethoxybutan-1-amine
CID 106657181
1-(cyclohexen-1-yl)-2-ethoxyethanamine
CID 106653369
1-(cyclohepten-1-yl)-2-propoxyethanamine
CID 106652723
1-(cycloocten-1-yl)-3-methylbutan-1-amine
CID 106652467
1-(cyclohepten-1-yl)-3-(4-methylphenyl)propan-1-amine
CID 106657002
1-pentan-2-ylcyclopentene
CID 21242449
2-(cyclohexen-1-yl)-1-(cycloocten-1-yl)ethanamine
CID 106654410
1-(cyclohexen-1-yl)-4-phenylbutan-1-amine
CID 106657277

Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexen-1-yl)butan-1-amine?
The IUPAC name of 1-(cyclohexen-1-yl)butan-1-amine (CID 62079375) is 1-(cyclohexen-1-yl)butan-1-amine.
What is the SMILES notation for 1-(cyclohexen-1-yl)butan-1-amine?
The canonical SMILES for 1-(cyclohexen-1-yl)butan-1-amine is CCCC(N)C1=CCCCC1.
What is the InChIKey of 1-(cyclohexen-1-yl)butan-1-amine?
The InChIKey is UXWPEJYSZQECHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-2-6-10(11)9-7-4-3-5-8-9/h7,10H,2-6,8,11H2,1H3.
What are the key properties of 1-(cyclohexen-1-yl)butan-1-amine?
1-(cyclohexen-1-yl)butan-1-amine has a molecular weight of 153.27 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexen-1-yl)butan-1-amine is sourced from PubChem (CID 62079375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).