3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-propan-2-ylpropanamide

C12H18N2O3 — CID 14956316

IUPAC3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-propan-2-ylpropanamide
SMILESCc1c(O)c(=O)ccn1CCC(=O)NC(C)C
InChIInChI=1S/C12H18N2O3/c1-8(2)13-11(16)5-7-14-6-4-10(15)12(17)9(14)3/h4,6,8,17H,5,7H2,1-3H3,(H,13,16)
InChIKeyNPAIBGUPYRLUDE-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.78
Rot. Bonds4

About 3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-propan-2-ylpropanamide

3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-propan-2-ylpropanamide (PubChem CID 14956316) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is 3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-propan-2-ylpropanamide
PubChem CID14956316
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC Name3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-propan-2-ylpropanamide
SMILESCc1c(O)c(=O)ccn1CCC(=O)NC(C)C
InChIInChI=1S/C12H18N2O3/c1-8(2)13-11(16)5-7-14-6-4-10(15)12(17)9(14)3/h4,6,8,17H,5,7H2,1-3H3,(H,13,16)
InChIKeyNPAIBGUPYRLUDE-UHFFFAOYSA-N
XLogP0.78
TPSA71.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(12-amino-4,9-diazadodecyl)-2-methyl-3-hydroxy-4(1H)-pyridinone
CID 11266903
N-[(3-hydroxy-1,6-dimethyl-4-oxo-1,4-dihydropyridin-2-yl)methyl]propanamide
CID 10263040
3-(3-Hydroxy-2-methyl-4-oxo-1(4H)-pyridinyl)-N-propylpropanamide
CID 13336721
3-(Acetylamino)-N-[(1,4-dihydro-3-hydroxy-1,6-dimethyl-4-oxo-2-pyridinyl)methyl]propanamide
CID 10468916
1(4H)-Pyridinebutanamide, 3-hydroxy-N,2-dimethyl-4-oxo-
CID 10609176
N-Ethyl-3-hydroxy-2-methyl-4-oxo-1(4H)-pyridinepropanamide
CID 14956315
N-Butyl-3-(3-hydroxy-2-methyl-4-oxopyridin-1(4H)-yl)propanamide
CID 14956317
4-Pyridinone,3-OH-2-Me-1-diMeAm-CO-Et-
CID 14956318
Propanamide, N-ethyl-3-(3-hydroxy-2-methyl-4-oxo
CID 14956319
4-Pyridinone,3-OH-2-Me-1-diEtAm-CO-Et-
CID 14956320
N-(2-(3-hydroxy-2-methyl-4-oxopyridin-1(4h)-yl)ethyl)methacrylamide
CID 44328200
1-(N-acetyl-6-aminohexyl)-3-hydroxy-2-methylpyridin-4-one
CID 117072346

Frequently Asked Questions

What is the IUPAC name of 3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-propan-2-ylpropanamide?
The IUPAC name of 3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-propan-2-ylpropanamide (CID 14956316) is 3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-propan-2-ylpropanamide.
What is the SMILES notation for 3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-propan-2-ylpropanamide?
The canonical SMILES for 3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-propan-2-ylpropanamide is Cc1c(O)c(=O)ccn1CCC(=O)NC(C)C.
What is the InChIKey of 3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-propan-2-ylpropanamide?
The InChIKey is NPAIBGUPYRLUDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c1-8(2)13-11(16)5-7-14-6-4-10(15)12(17)9(14)3/h4,6,8,17H,5,7H2,1-3H3,(H,13,16).
What are the key properties of 3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-propan-2-ylpropanamide?
3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-propan-2-ylpropanamide has a molecular weight of 238.29 g/mol, XLogP of 0.78, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-propan-2-ylpropanamide is sourced from PubChem (CID 14956316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).