(2E)-2-ethenyl-N,N-dimethylpenta-2,4-dienamide

C9H13NO — CID 142465051

IUPAC(2E)-2-ethenyl-N,N-dimethylpenta-2,4-dienamide
SMILESC=C/C=C(\C=C)C(=O)N(C)C
InChIInChI=1S/C9H13NO/c1-5-7-8(6-2)9(11)10(3)4/h5-7H,1-2H2,3-4H3/b8-7+
InChIKeyONDSMWFNSALHOK-BQYQJAHWSA-N
MW151.21 g/mol
LogP1.37
Rot. Bonds3

About (2E)-2-ethenyl-N,N-dimethylpenta-2,4-dienamide

(2E)-2-ethenyl-N,N-dimethylpenta-2,4-dienamide (PubChem CID 142465051) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is (2E)-2-ethenyl-N,N-dimethylpenta-2,4-dienamide.

Molecular Properties

Compound Name(2E)-2-ethenyl-N,N-dimethylpenta-2,4-dienamide
PubChem CID142465051
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name(2E)-2-ethenyl-N,N-dimethylpenta-2,4-dienamide
SMILESC=C/C=C(\C=C)C(=O)N(C)C
InChIInChI=1S/C9H13NO/c1-5-7-8(6-2)9(11)10(3)4/h5-7H,1-2H2,3-4H3/b8-7+
InChIKeyONDSMWFNSALHOK-BQYQJAHWSA-N
XLogP1.37
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze (2E)-2-ethenyl-N,N-dimethylpenta-2,4-dienamide 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

(2E)-2-ethenyl-N,N,5-trimethylhexa-2,4-dienamide
CID 143537034
2-ethenyl-N,N-diethylpenta-2,4-dienamide
CID 91586528
(2E,4Z)-2-ethenyl-N,N,4-trimethylhexa-2,4-dienamide
CID 143013710
(2E,3Z)-2-ethylidene-N,N-dimethylhexa-3,5-dienamide
CID 118361831
(2E)-2-ethenylpenta-2,4-dienethioic S-acid
CID 142851404
(2E)-N-ethyl-N-methyl-2-[(Z)-prop-1-enyl]penta-2,4-dienamide
CID 129043675
ethane;(3E,6E)-4-ethenyl-6-[(Z)-prop-1-enyl]nona-1,3,6,8-tetraen-5-one
CID 142285678
(5E)-5-ethenylocta-1,5,7-trien-4-one
CID 90463748
N-methyl-N-[(3E)-2-methylhexa-1,3,5-trien-3-yl]acetamide
CID 143409642
ethane;(3E)-3-ethenyl-2-methylhexa-1,3,5-triene;2-methylprop-1-ene
CID 142058077
(2E)-1-cyclohepta-1,3,6-trien-1-yl-2-ethenylpenta-2,4-dien-1-one;ethane
CID 155599989
N,N-dimethyl-4-prop-2-enoylpiperazine-1-carboxamide
CID 60949594

Frequently Asked Questions

What is the IUPAC name of (2E)-2-ethenyl-N,N-dimethylpenta-2,4-dienamide?
The IUPAC name of (2E)-2-ethenyl-N,N-dimethylpenta-2,4-dienamide (CID 142465051) is (2E)-2-ethenyl-N,N-dimethylpenta-2,4-dienamide.
What is the SMILES notation for (2E)-2-ethenyl-N,N-dimethylpenta-2,4-dienamide?
The canonical SMILES for (2E)-2-ethenyl-N,N-dimethylpenta-2,4-dienamide is C=C/C=C(\C=C)C(=O)N(C)C.
What is the InChIKey of (2E)-2-ethenyl-N,N-dimethylpenta-2,4-dienamide?
The InChIKey is ONDSMWFNSALHOK-BQYQJAHWSA-N. The full InChI is InChI=1S/C9H13NO/c1-5-7-8(6-2)9(11)10(3)4/h5-7H,1-2H2,3-4H3/b8-7+.
What are the key properties of (2E)-2-ethenyl-N,N-dimethylpenta-2,4-dienamide?
(2E)-2-ethenyl-N,N-dimethylpenta-2,4-dienamide has a molecular weight of 151.21 g/mol, XLogP of 1.37, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-ethenyl-N,N-dimethylpenta-2,4-dienamide is sourced from PubChem (CID 142465051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).