4-(cyclohexen-1-yl)butanamide

C10H17NO — CID 165359181

IUPAC4-(cyclohexen-1-yl)butanamide
SMILESNC(=O)CCCC1=CCCCC1
InChIInChI=1S/C10H17NO/c11-10(12)8-4-7-9-5-2-1-3-6-9/h5H,1-4,6-8H2,(H2,11,12)
InChIKeyPMWYTIIPIZDLMJ-UHFFFAOYSA-N
MW167.25 g/mol
LogP2.14
Rot. Bonds4

About 4-(cyclohexen-1-yl)butanamide

4-(cyclohexen-1-yl)butanamide (PubChem CID 165359181) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 4-(cyclohexen-1-yl)butanamide.

Molecular Properties

Compound Name4-(cyclohexen-1-yl)butanamide
PubChem CID165359181
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name4-(cyclohexen-1-yl)butanamide
SMILESNC(=O)CCCC1=CCCCC1
InChIInChI=1S/C10H17NO/c11-10(12)8-4-7-9-5-2-1-3-6-9/h5H,1-4,6-8H2,(H2,11,12)
InChIKeyPMWYTIIPIZDLMJ-UHFFFAOYSA-N
XLogP2.14
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 4-(cyclohexen-1-yl)butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9-amino-1-(cyclohexen-1-yl)nonan-4-one
CID 71055210
6-(cyclohexen-1-yl)-3-oxohexanenitrile
CID 121011006
7-(cyclopenten-1-yl)heptanoic acid
CID 23035884
1-[4-(cyclopenten-1-yl)butyl]cyclopentene
CID 10420053
4-[2-(cyclohexen-1-yl)ethylamino]butanoic acid
CID 62324339
ethyl 3-(cyclohepten-1-yl)propanoate
CID 135031394
1-butylcyclononene
CID 56981158
(2S)-5-amino-2-[2-(cyclohexen-1-yl)ethylcarbamoylamino]-5-oxopentanoic acid
CID 103994434
2-(cyclopenten-1-ylmethylsulfanyl)acetamide
CID 146081497
5-[2-(cyclohexen-1-yl)ethylamino]-5-oxopentanoic acid
CID 2932918
1-pentylcyclododecene
CID 150654776
1-octylcyclohexene
CID 519088

Frequently Asked Questions

What is the IUPAC name of 4-(cyclohexen-1-yl)butanamide?
The IUPAC name of 4-(cyclohexen-1-yl)butanamide (CID 165359181) is 4-(cyclohexen-1-yl)butanamide.
What is the SMILES notation for 4-(cyclohexen-1-yl)butanamide?
The canonical SMILES for 4-(cyclohexen-1-yl)butanamide is NC(=O)CCCC1=CCCCC1.
What is the InChIKey of 4-(cyclohexen-1-yl)butanamide?
The InChIKey is PMWYTIIPIZDLMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c11-10(12)8-4-7-9-5-2-1-3-6-9/h5H,1-4,6-8H2,(H2,11,12).
What are the key properties of 4-(cyclohexen-1-yl)butanamide?
4-(cyclohexen-1-yl)butanamide has a molecular weight of 167.25 g/mol, XLogP of 2.14, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclohexen-1-yl)butanamide is sourced from PubChem (CID 165359181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).