1-methyl-5-(3-propanoylimidazolidine-1-carbonyl)pyridin-2-one

C13H17N3O3 — CID 128893120

IUPAC1-methyl-5-(3-propanoylimidazolidine-1-carbonyl)pyridin-2-one
SMILESCCC(=O)N1CCN(C(=O)c2ccc(=O)n(C)c2)C1
InChIInChI=1S/C13H17N3O3/c1-3-11(17)15-6-7-16(9-15)13(19)10-4-5-12(18)14(2)8-10/h4-5,8H,3,6-7,9H2,1-2H3
InChIKeyMZZLHXDMWWYKQR-UHFFFAOYSA-N
MW263.30 g/mol
LogP0.04
Rot. Bonds2

About 1-methyl-5-(3-propanoylimidazolidine-1-carbonyl)pyridin-2-one

1-methyl-5-(3-propanoylimidazolidine-1-carbonyl)pyridin-2-one (PubChem CID 128893120) has the molecular formula C13H17N3O3 and a molecular weight of 263.30 g/mol. Its IUPAC name is 1-methyl-5-(3-propanoylimidazolidine-1-carbonyl)pyridin-2-one.

Molecular Properties

Compound Name1-methyl-5-(3-propanoylimidazolidine-1-carbonyl)pyridin-2-one
PubChem CID128893120
Molecular FormulaC13H17N3O3
Molecular Weight263.30 g/mol
Exact Mass263.13
IUPAC Name1-methyl-5-(3-propanoylimidazolidine-1-carbonyl)pyridin-2-one
SMILESCCC(=O)N1CCN(C(=O)c2ccc(=O)n(C)c2)C1
InChIInChI=1S/C13H17N3O3/c1-3-11(17)15-6-7-16(9-15)13(19)10-4-5-12(18)14(2)8-10/h4-5,8H,3,6-7,9H2,1-2H3
InChIKeyMZZLHXDMWWYKQR-UHFFFAOYSA-N
XLogP0.04
TPSA62.62 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 50.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-(4-methylbenzoyl)imidazolidin-1-yl]propan-1-one
CID 4621102
1-methyl-5-(4-methylsulfonylpiperazine-1-carbonyl)pyridin-2-one
CID 75461426
1-methyl-5-(5-propanoylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-carbonyl)pyridin-2-one
CID 72865518
1-methyl-5-[(4S)-4-methylazepane-1-carbonyl]pyridin-2-one
CID 95591235
1-methyl-5-[4-(3-pyridin-4-ylpropanoyl)-1,4-diazepane-1-carbonyl]pyridin-2-one
CID 137337200
1-methyl-5-[4-[(3-methylphenyl)methyl]piperazine-1-carbonyl]pyridin-2-one
CID 70779876
1-methyl-5-[4-[(1R)-1-pyrrolidin-1-ylethyl]piperidine-1-carbonyl]pyridin-2-one
CID 95873949
5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-1-methylpyridin-2-one
CID 110693026
5-[3-(4-methoxyphenyl)-4-methylpiperazine-1-carbonyl]-1-methylpyridin-2-one
CID 110109723
3-[(3S)-1-(1-methyl-6-oxopyridine-3-carbonyl)piperidin-3-yl]propanoic acid
CID 124697707
1-methyl-5-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]pyridin-2-one
CID 127339699
1-methyl-5-[4-(4-phenylpyrimidin-2-yl)piperazine-1-carbonyl]pyridin-2-one
CID 77090822

Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-(3-propanoylimidazolidine-1-carbonyl)pyridin-2-one?
The IUPAC name of 1-methyl-5-(3-propanoylimidazolidine-1-carbonyl)pyridin-2-one (CID 128893120) is 1-methyl-5-(3-propanoylimidazolidine-1-carbonyl)pyridin-2-one.
What is the SMILES notation for 1-methyl-5-(3-propanoylimidazolidine-1-carbonyl)pyridin-2-one?
The canonical SMILES for 1-methyl-5-(3-propanoylimidazolidine-1-carbonyl)pyridin-2-one is CCC(=O)N1CCN(C(=O)c2ccc(=O)n(C)c2)C1.
What is the InChIKey of 1-methyl-5-(3-propanoylimidazolidine-1-carbonyl)pyridin-2-one?
The InChIKey is MZZLHXDMWWYKQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O3/c1-3-11(17)15-6-7-16(9-15)13(19)10-4-5-12(18)14(2)8-10/h4-5,8H,3,6-7,9H2,1-2H3.
What are the key properties of 1-methyl-5-(3-propanoylimidazolidine-1-carbonyl)pyridin-2-one?
1-methyl-5-(3-propanoylimidazolidine-1-carbonyl)pyridin-2-one has a molecular weight of 263.30 g/mol, XLogP of 0.04, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-(3-propanoylimidazolidine-1-carbonyl)pyridin-2-one is sourced from PubChem (CID 128893120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).