3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-methylsulfonylpropanamide

C14H16N4O4S — CID 146154481

IUPAC3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-methylsulfonylpropanamide
SMILESCc1nc(-c2ccncc2)[nH]c(=O)c1CCC(=O)NS(C)(=O)=O
InChIInChI=1S/C14H16N4O4S/c1-9-11(3-4-12(19)18-23(2,21)22)14(20)17-13(16-9)10-5-7-15-8-6-10/h5-8H,3-4H2,1-2H3,(H,18,19)(H,16,17,20)
InChIKeyHVIOWRZNHGRIBY-UHFFFAOYSA-N
MW336.37 g/mol
LogP0.15
Rot. Bonds5

About 3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-methylsulfonylpropanamide

3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-methylsulfonylpropanamide (PubChem CID 146154481) has the molecular formula C14H16N4O4S and a molecular weight of 336.37 g/mol. Its IUPAC name is 3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-methylsulfonylpropanamide.

Molecular Properties

Compound Name3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-methylsulfonylpropanamide
PubChem CID146154481
Molecular FormulaC14H16N4O4S
Molecular Weight336.37 g/mol
Exact Mass336.09
IUPAC Name3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-methylsulfonylpropanamide
SMILESCc1nc(-c2ccncc2)[nH]c(=O)c1CCC(=O)NS(C)(=O)=O
InChIInChI=1S/C14H16N4O4S/c1-9-11(3-4-12(19)18-23(2,21)22)14(20)17-13(16-9)10-5-7-15-8-6-10/h5-8H,3-4H2,1-2H3,(H,18,19)(H,16,17,20)
InChIKeyHVIOWRZNHGRIBY-UHFFFAOYSA-N
XLogP0.15
TPSA121.88 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.37
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-methylsulfonylpropanamide 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

N-[(2S)-butan-2-yl]-3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)propanamide
CID 136773410
N-[1-(cyclopropylmethyl)piperidin-4-yl]-3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)propanamide
CID 136579963
N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)-3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)propanamide
CID 167945291
N-(cyclopropylmethyl)-2-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)acetamide
CID 135983224
3-[2-(4-fluorophenyl)-4-methyl-6-oxo-1H-pyrimidin-5-yl]propanoic acid
CID 135973653
3-(4-methyl-2-methylsulfanyl-6-oxo-1H-pyrimidin-5-yl)-N-pyridin-4-ylpropanamide
CID 135956168
N-(2-amino-2-ethylbutyl)-3-(4-methyl-6-oxo-2-pyridin-3-yl-1H-pyrimidin-5-yl)propanamide
CID 137078585
N-(5-methyl-1,2-oxazol-3-yl)-3-(4-methyl-6-oxo-2-phenyl-1H-pyrimidin-5-yl)propanamide
CID 135676905
N-(2-amino-2-ethylbutyl)-3-(4-methyl-6-oxo-2-pyridin-3-yl-1H-pyrimidin-5-yl)propanamide;dihydrochloride
CID 137078584
4-methyl-5-[3-oxo-3-(2-propanoylpiperidin-1-yl)propyl]-2-pyridin-4-yl-1H-pyrimidin-6-one
CID 136532660
3-(4-methyl-6-oxo-2-pyridin-3-yl-1H-pyrimidin-5-yl)-N-[(3R)-2-methylpentan-3-yl]propanamide
CID 136877410
(2R)-3-methyl-2-[3-(4-methyl-6-oxo-2-pyridin-3-yl-1H-pyrimidin-5-yl)propanoylamino]butanoic acid
CID 136942120

Frequently Asked Questions

What is the IUPAC name of 3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-methylsulfonylpropanamide?
The IUPAC name of 3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-methylsulfonylpropanamide (CID 146154481) is 3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-methylsulfonylpropanamide.
What is the SMILES notation for 3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-methylsulfonylpropanamide?
The canonical SMILES for 3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-methylsulfonylpropanamide is Cc1nc(-c2ccncc2)[nH]c(=O)c1CCC(=O)NS(C)(=O)=O.
What is the InChIKey of 3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-methylsulfonylpropanamide?
The InChIKey is HVIOWRZNHGRIBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O4S/c1-9-11(3-4-12(19)18-23(2,21)22)14(20)17-13(16-9)10-5-7-15-8-6-10/h5-8H,3-4H2,1-2H3,(H,18,19)(H,16,17,20).
What are the key properties of 3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-methylsulfonylpropanamide?
3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-methylsulfonylpropanamide has a molecular weight of 336.37 g/mol, XLogP of 0.15, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methyl-6-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-methylsulfonylpropanamide is sourced from PubChem (CID 146154481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).