2-methyl-8H-pyrido[2,3-d]pyrimidin-5-one

C8H7N3O — CID 130251266

IUPAC2-methyl-8H-pyrido[2,3-d]pyrimidin-5-one
SMILESCc1ncc2c(=O)cc[nH]c2n1
InChIInChI=1S/C8H7N3O/c1-5-10-4-6-7(12)2-3-9-8(6)11-5/h2-4H,1H3,(H,9,10,11,12)
InChIKeyQSVARDJLTUNIEP-UHFFFAOYSA-N
MW161.16 g/mol
LogP0.63
Rot. Bonds

About 2-methyl-8H-pyrido[2,3-d]pyrimidin-5-one

2-methyl-8H-pyrido[2,3-d]pyrimidin-5-one (PubChem CID 130251266) has the molecular formula C8H7N3O and a molecular weight of 161.16 g/mol. Its IUPAC name is 2-methyl-8H-pyrido[2,3-d]pyrimidin-5-one.

Molecular Properties

Compound Name2-methyl-8H-pyrido[2,3-d]pyrimidin-5-one
PubChem CID130251266
Molecular FormulaC8H7N3O
Molecular Weight161.16 g/mol
Exact Mass161.06
IUPAC Name2-methyl-8H-pyrido[2,3-d]pyrimidin-5-one
SMILESCc1ncc2c(=O)cc[nH]c2n1
InChIInChI=1S/C8H7N3O/c1-5-10-4-6-7(12)2-3-9-8(6)11-5/h2-4H,1H3,(H,9,10,11,12)
InChIKeyQSVARDJLTUNIEP-UHFFFAOYSA-N
XLogP0.63
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.16
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

dichlorocopper;7-methyl-1H-1,8-naphthyridin-4-one
CID 70610790
6-bromo-7-methyl-1H-1,8-naphthyridin-4-one
CID 19374329
5-ethyl-2-methyl-7H-pyrrolo[2,3-d]pyrimidine
CID 123585773
ethane;7-methoxy-1H-1,8-naphthyridin-4-one
CID 155694720
6-chloro-1H-1,8-naphthyridin-4-one
CID 53485717
4-chloro-2-methyl-5H-pyrido[3,2-d]pyrimidin-8-one
CID 174272394
2-methyl-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
CID 82652088
2-methyl-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one
CID 135500331
2-methyl-1,4-dihydroimidazo[4,5-b]pyridin-7-one
CID 58931349
2-methyl-4-methylsulfanyl-7H-pyrrolo[2,3-d]pyrimidine
CID 130614883
7-propan-2-yl-1H-1,6-naphthyridin-4-one
CID 122697402
5-(2-methylpyrimidin-5-yl)-1H-pyrrolo[2,3-b]pyridine
CID 140781014

Frequently Asked Questions

What is the IUPAC name of 2-methyl-8H-pyrido[2,3-d]pyrimidin-5-one?
The IUPAC name of 2-methyl-8H-pyrido[2,3-d]pyrimidin-5-one (CID 130251266) is 2-methyl-8H-pyrido[2,3-d]pyrimidin-5-one.
What is the SMILES notation for 2-methyl-8H-pyrido[2,3-d]pyrimidin-5-one?
The canonical SMILES for 2-methyl-8H-pyrido[2,3-d]pyrimidin-5-one is Cc1ncc2c(=O)cc[nH]c2n1.
What is the InChIKey of 2-methyl-8H-pyrido[2,3-d]pyrimidin-5-one?
The InChIKey is QSVARDJLTUNIEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3O/c1-5-10-4-6-7(12)2-3-9-8(6)11-5/h2-4H,1H3,(H,9,10,11,12).
What are the key properties of 2-methyl-8H-pyrido[2,3-d]pyrimidin-5-one?
2-methyl-8H-pyrido[2,3-d]pyrimidin-5-one has a molecular weight of 161.16 g/mol, XLogP of 0.63, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-8H-pyrido[2,3-d]pyrimidin-5-one is sourced from PubChem (CID 130251266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).