8-methyl-6-phenyl-2-(pyridin-4-ylamino)pyrido[2,3-d]pyrimidin-7-one

C19H15N5O — CID 5328639

IUPAC8-methyl-6-phenyl-2-(pyridin-4-ylamino)pyrido[2,3-d]pyrimidin-7-one
SMILESCn1c(=O)c(-c2ccccc2)cc2cnc(Nc3ccncc3)nc21
InChIInChI=1S/C19H15N5O/c1-24-17-14(11-16(18(24)25)13-5-3-2-4-6-13)12-21-19(23-17)22-15-7-9-20-10-8-15/h2-12H,1H3,(H,20,21,22,23)
InChIKeyJHUVEQYRBIPKAU-UHFFFAOYSA-N
MW329.36 g/mol
LogP3.13
Rot. Bonds3

About 8-methyl-6-phenyl-2-(pyridin-4-ylamino)pyrido[2,3-d]pyrimidin-7-one

8-methyl-6-phenyl-2-(pyridin-4-ylamino)pyrido[2,3-d]pyrimidin-7-one (PubChem CID 5328639) has the molecular formula C19H15N5O and a molecular weight of 329.36 g/mol. Its IUPAC name is 8-methyl-6-phenyl-2-(pyridin-4-ylamino)pyrido[2,3-d]pyrimidin-7-one.

Molecular Properties

Compound Name8-methyl-6-phenyl-2-(pyridin-4-ylamino)pyrido[2,3-d]pyrimidin-7-one
PubChem CID5328639
Molecular FormulaC19H15N5O
Molecular Weight329.36 g/mol
Exact Mass329.13
IUPAC Name8-methyl-6-phenyl-2-(pyridin-4-ylamino)pyrido[2,3-d]pyrimidin-7-one
SMILESCn1c(=O)c(-c2ccccc2)cc2cnc(Nc3ccncc3)nc21
InChIInChI=1S/C19H15N5O/c1-24-17-14(11-16(18(24)25)13-5-3-2-4-6-13)12-21-19(23-17)22-15-7-9-20-10-8-15/h2-12H,1H3,(H,20,21,22,23)
InChIKeyJHUVEQYRBIPKAU-UHFFFAOYSA-N
XLogP3.13
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-6-phenyl-2-(pyridin-4-ylamino)pyrido[2,3-d]pyrimidin-7-one?
The IUPAC name of 8-methyl-6-phenyl-2-(pyridin-4-ylamino)pyrido[2,3-d]pyrimidin-7-one (CID 5328639) is 8-methyl-6-phenyl-2-(pyridin-4-ylamino)pyrido[2,3-d]pyrimidin-7-one.
What is the SMILES notation for 8-methyl-6-phenyl-2-(pyridin-4-ylamino)pyrido[2,3-d]pyrimidin-7-one?
The canonical SMILES for 8-methyl-6-phenyl-2-(pyridin-4-ylamino)pyrido[2,3-d]pyrimidin-7-one is Cn1c(=O)c(-c2ccccc2)cc2cnc(Nc3ccncc3)nc21.
What is the InChIKey of 8-methyl-6-phenyl-2-(pyridin-4-ylamino)pyrido[2,3-d]pyrimidin-7-one?
The InChIKey is JHUVEQYRBIPKAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5O/c1-24-17-14(11-16(18(24)25)13-5-3-2-4-6-13)12-21-19(23-17)22-15-7-9-20-10-8-15/h2-12H,1H3,(H,20,21,22,23).
What are the key properties of 8-methyl-6-phenyl-2-(pyridin-4-ylamino)pyrido[2,3-d]pyrimidin-7-one?
8-methyl-6-phenyl-2-(pyridin-4-ylamino)pyrido[2,3-d]pyrimidin-7-one has a molecular weight of 329.36 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-6-phenyl-2-(pyridin-4-ylamino)pyrido[2,3-d]pyrimidin-7-one is sourced from PubChem (CID 5328639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).