N-cyclohexa-1,5-dien-1-ylbutanamide

C10H15NO — CID 18707393

IUPACN-cyclohexa-1,5-dien-1-ylbutanamide
SMILESCCCC(=O)NC1=CCCC=C1
InChIInChI=1S/C10H15NO/c1-2-6-10(12)11-9-7-4-3-5-8-9/h4,7-8H,2-3,5-6H2,1H3,(H,11,12)
InChIKeyINHCIUUVJOQQBO-UHFFFAOYSA-N
MW165.24 g/mol
LogP2.14
Rot. Bonds3

About N-cyclohexa-1,5-dien-1-ylbutanamide

N-cyclohexa-1,5-dien-1-ylbutanamide (PubChem CID 18707393) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is N-cyclohexa-1,5-dien-1-ylbutanamide.

Molecular Properties

Compound NameN-cyclohexa-1,5-dien-1-ylbutanamide
PubChem CID18707393
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC NameN-cyclohexa-1,5-dien-1-ylbutanamide
SMILESCCCC(=O)NC1=CCCC=C1
InChIInChI=1S/C10H15NO/c1-2-6-10(12)11-9-7-4-3-5-8-9/h4,7-8H,2-3,5-6H2,1H3,(H,11,12)
InChIKeyINHCIUUVJOQQBO-UHFFFAOYSA-N
XLogP2.14
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-cyclohexa-1,5-dien-1-ylbutanamide 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

3,4-Dihydro-6-methyl-2-pyridone
CID 82550
1H-Pyridin-2-one, 6-ethyl-
CID 182320
N-acetylcyclohexadienylamine
CID 19382580
6-Butylpyridin-2-ol
CID 23352100
3-ethyl-6-methyl-1H-pyridin-2-one
CID 2797876
N-(3-fluorocyclohexa-1,5-dien-1-yl)acetamide
CID 89363295
5-fluoro-6-methylidene-3-propan-2-yl-3H-pyridin-2-one
CID 118446180
N-(6-fluoro-2-prop-1-en-2-ylcyclohexa-1,3-dien-1-yl)acetamide
CID 123819181
N-cyclohexa-1,3-dien-1-yl-2,2,3,3,4,4,4-heptafluorobutanamide
CID 139438484
N-(2,4-difluorocyclohexa-1,5-dien-1-yl)acetamide
CID 142113001
N-(4-fluorocyclohexa-1,3-dien-1-yl)acetamide
CID 143299281
4-[(E)-2-fluoroethenyl]-5-[(Z)-prop-1-enyl]-1,3-dihydropyrrol-2-one
CID 143920331

Frequently Asked Questions

What is the IUPAC name of N-cyclohexa-1,5-dien-1-ylbutanamide?
The IUPAC name of N-cyclohexa-1,5-dien-1-ylbutanamide (CID 18707393) is N-cyclohexa-1,5-dien-1-ylbutanamide.
What is the SMILES notation for N-cyclohexa-1,5-dien-1-ylbutanamide?
The canonical SMILES for N-cyclohexa-1,5-dien-1-ylbutanamide is CCCC(=O)NC1=CCCC=C1.
What is the InChIKey of N-cyclohexa-1,5-dien-1-ylbutanamide?
The InChIKey is INHCIUUVJOQQBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-2-6-10(12)11-9-7-4-3-5-8-9/h4,7-8H,2-3,5-6H2,1H3,(H,11,12).
What are the key properties of N-cyclohexa-1,5-dien-1-ylbutanamide?
N-cyclohexa-1,5-dien-1-ylbutanamide has a molecular weight of 165.24 g/mol, XLogP of 2.14, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexa-1,5-dien-1-ylbutanamide is sourced from PubChem (CID 18707393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).