1-methyl-4-prop-2-enyl-3,4-dihydropyridin-2-one

C9H13NO — CID 102398243

IUPAC1-methyl-4-prop-2-enyl-3,4-dihydropyridin-2-one
SMILESC=CCC1C=CN(C)C(=O)C1
InChIInChI=1S/C9H13NO/c1-3-4-8-5-6-10(2)9(11)7-8/h3,5-6,8H,1,4,7H2,2H3
InChIKeyLRABUBZJLQEZGR-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.55
Rot. Bonds2

About 1-methyl-4-prop-2-enyl-3,4-dihydropyridin-2-one

1-methyl-4-prop-2-enyl-3,4-dihydropyridin-2-one (PubChem CID 102398243) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is 1-methyl-4-prop-2-enyl-3,4-dihydropyridin-2-one.

Molecular Properties

Compound Name1-methyl-4-prop-2-enyl-3,4-dihydropyridin-2-one
PubChem CID102398243
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name1-methyl-4-prop-2-enyl-3,4-dihydropyridin-2-one
SMILESC=CCC1C=CN(C)C(=O)C1
InChIInChI=1S/C9H13NO/c1-3-4-8-5-6-10(2)9(11)7-8/h3,5-6,8H,1,4,7H2,2H3
InChIKeyLRABUBZJLQEZGR-UHFFFAOYSA-N
XLogP1.55
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-methyl-4-methyliodanuidyl-3,4-dihydropyridin-2-one
CID 163648674
(4Z)-3-prop-2-enylcyclonon-4-en-1-one
CID 12742774
(4S)-4-prop-2-enylcyclohex-2-en-1-one
CID 93148193
1-oxido-4-prop-2-enylazetidin-2-one
CID 88721665
1-methyl-3,4-bis(prop-2-enyl)pyrrolidine-2,5-dione
CID 155096687
2-hydroxy-4-prop-2-enylcyclohex-2-en-1-one
CID 45082974
(7R)-1-methyl-7-prop-2-enylazepan-2-one
CID 59072764
(2S,5S)-5-methyl-1,2-bis(prop-2-enyl)pyrrolidin-3-one
CID 101173596
(3R)-1-methyl-3-prop-2-enylpyrrolidin-2-one
CID 129366009
CID 15963515
CID 15963515
(3S)-1-(4-chlorophenyl)-3-prop-2-enylpyrrolidine-2,5-dione
CID 6925610
4-ethenyl-1-ethylazetidin-2-one
CID 150972777

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-prop-2-enyl-3,4-dihydropyridin-2-one?
The IUPAC name of 1-methyl-4-prop-2-enyl-3,4-dihydropyridin-2-one (CID 102398243) is 1-methyl-4-prop-2-enyl-3,4-dihydropyridin-2-one.
What is the SMILES notation for 1-methyl-4-prop-2-enyl-3,4-dihydropyridin-2-one?
The canonical SMILES for 1-methyl-4-prop-2-enyl-3,4-dihydropyridin-2-one is C=CCC1C=CN(C)C(=O)C1.
What is the InChIKey of 1-methyl-4-prop-2-enyl-3,4-dihydropyridin-2-one?
The InChIKey is LRABUBZJLQEZGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-3-4-8-5-6-10(2)9(11)7-8/h3,5-6,8H,1,4,7H2,2H3.
What are the key properties of 1-methyl-4-prop-2-enyl-3,4-dihydropyridin-2-one?
1-methyl-4-prop-2-enyl-3,4-dihydropyridin-2-one has a molecular weight of 151.21 g/mol, XLogP of 1.55, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-prop-2-enyl-3,4-dihydropyridin-2-one is sourced from PubChem (CID 102398243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).