2-methyl-N-prop-2-enylpent-4-enamide

C9H15NO — CID 22036669

IUPAC2-methyl-N-prop-2-enylpent-4-enamide
SMILESC=CCNC(=O)C(C)CC=C
InChIInChI=1S/C9H15NO/c1-4-6-8(3)9(11)10-7-5-2/h4-5,8H,1-2,6-7H2,3H3,(H,10,11)
InChIKeyRPQJUXUJMBJSGY-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.50
Rot. Bonds5

About 2-methyl-N-prop-2-enylpent-4-enamide

2-methyl-N-prop-2-enylpent-4-enamide (PubChem CID 22036669) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is 2-methyl-N-prop-2-enylpent-4-enamide.

Molecular Properties

Compound Name2-methyl-N-prop-2-enylpent-4-enamide
PubChem CID22036669
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name2-methyl-N-prop-2-enylpent-4-enamide
SMILESC=CCNC(=O)C(C)CC=C
InChIInChI=1S/C9H15NO/c1-4-6-8(3)9(11)10-7-5-2/h4-5,8H,1-2,6-7H2,3H3,(H,10,11)
InChIKeyRPQJUXUJMBJSGY-UHFFFAOYSA-N
XLogP1.50
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-methyl-N-prop-2-enylpent-4-enamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-prop-2-enylpent-4-enamide?
The IUPAC name of 2-methyl-N-prop-2-enylpent-4-enamide (CID 22036669) is 2-methyl-N-prop-2-enylpent-4-enamide.
What is the SMILES notation for 2-methyl-N-prop-2-enylpent-4-enamide?
The canonical SMILES for 2-methyl-N-prop-2-enylpent-4-enamide is C=CCNC(=O)C(C)CC=C.
What is the InChIKey of 2-methyl-N-prop-2-enylpent-4-enamide?
The InChIKey is RPQJUXUJMBJSGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-4-6-8(3)9(11)10-7-5-2/h4-5,8H,1-2,6-7H2,3H3,(H,10,11).
What are the key properties of 2-methyl-N-prop-2-enylpent-4-enamide?
2-methyl-N-prop-2-enylpent-4-enamide has a molecular weight of 153.22 g/mol, XLogP of 1.50, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-prop-2-enylpent-4-enamide is sourced from PubChem (CID 22036669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).