4-methyl-2-phenyl-8H-pyrido[2,3-d]pyrimidin-7-one

C14H11N3O — CID 12795382

IUPAC4-methyl-2-phenyl-8H-pyrido[2,3-d]pyrimidin-7-one
SMILESCc1nc(-c2ccccc2)nc2[nH]c(=O)ccc12
InChIInChI=1S/C14H11N3O/c1-9-11-7-8-12(18)16-14(11)17-13(15-9)10-5-3-2-4-6-10/h2-8H,1H3,(H,15,16,17,18)
InChIKeyODTVYRCNBXYYEU-UHFFFAOYSA-N
MW237.26 g/mol
LogP2.29
Rot. Bonds1

About 4-methyl-2-phenyl-8H-pyrido[2,3-d]pyrimidin-7-one

4-methyl-2-phenyl-8H-pyrido[2,3-d]pyrimidin-7-one (PubChem CID 12795382) has the molecular formula C14H11N3O and a molecular weight of 237.26 g/mol. Its IUPAC name is 4-methyl-2-phenyl-8H-pyrido[2,3-d]pyrimidin-7-one.

Molecular Properties

Compound Name4-methyl-2-phenyl-8H-pyrido[2,3-d]pyrimidin-7-one
PubChem CID12795382
Molecular FormulaC14H11N3O
Molecular Weight237.26 g/mol
Exact Mass237.09
IUPAC Name4-methyl-2-phenyl-8H-pyrido[2,3-d]pyrimidin-7-one
SMILESCc1nc(-c2ccccc2)nc2[nH]c(=O)ccc12
InChIInChI=1S/C14H11N3O/c1-9-11-7-8-12(18)16-14(11)17-13(15-9)10-5-3-2-4-6-10/h2-8H,1H3,(H,15,16,17,18)
InChIKeyODTVYRCNBXYYEU-UHFFFAOYSA-N
XLogP2.29
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Luf-5735
CID 11392960
4-Amino-2,6-diphenylpyrimidine
CID 619020
Pentanoic acid (4,6-diphenylpyrimidin-2-yl)amide
CID 11450364
N-(2,6-diphenylpyrimidin-4-yl)acetamide
CID 11185362
N-(2,6-diphenylpyrimidin-4-yl)benzamide
CID 11245073
N-(4,6-diphenylpyrimidin-2-yl)propionamide
CID 11278089
N-(4,6-diphenylpyrimidin-2-yl)-2-ethylbutyramide
CID 11290921
N-(4,6-diphenylpyrimidin-2-yl)-3-methylbutyramide
CID 11301995
N-(2,6-diphenylpyrimidin-4-yl)isobutyramide
CID 11313151
N-(2,6-diphenylpyrimidin-4-yl)butyramide
CID 11359018
N-(2,6-diphenylpyrimidin-4-yl)-2-ethylbutyramide
CID 11371386
Propanamide, N-(4,6-diphenyl-2-pyrimidinyl)-2-methyl-
CID 11381543

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-phenyl-8H-pyrido[2,3-d]pyrimidin-7-one?
The IUPAC name of 4-methyl-2-phenyl-8H-pyrido[2,3-d]pyrimidin-7-one (CID 12795382) is 4-methyl-2-phenyl-8H-pyrido[2,3-d]pyrimidin-7-one.
What is the SMILES notation for 4-methyl-2-phenyl-8H-pyrido[2,3-d]pyrimidin-7-one?
The canonical SMILES for 4-methyl-2-phenyl-8H-pyrido[2,3-d]pyrimidin-7-one is Cc1nc(-c2ccccc2)nc2[nH]c(=O)ccc12.
What is the InChIKey of 4-methyl-2-phenyl-8H-pyrido[2,3-d]pyrimidin-7-one?
The InChIKey is ODTVYRCNBXYYEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O/c1-9-11-7-8-12(18)16-14(11)17-13(15-9)10-5-3-2-4-6-10/h2-8H,1H3,(H,15,16,17,18).
What are the key properties of 4-methyl-2-phenyl-8H-pyrido[2,3-d]pyrimidin-7-one?
4-methyl-2-phenyl-8H-pyrido[2,3-d]pyrimidin-7-one has a molecular weight of 237.26 g/mol, XLogP of 2.29, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-phenyl-8H-pyrido[2,3-d]pyrimidin-7-one is sourced from PubChem (CID 12795382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).