2,6,7-trimethyl-3H-pyrido[2,3-d]pyrimidin-4-one

C10H11N3O — CID 137292833

IUPAC2,6,7-trimethyl-3H-pyrido[2,3-d]pyrimidin-4-one
SMILESCc1nc2nc(C)c(C)cc2c(=O)[nH]1
InChIInChI=1S/C10H11N3O/c1-5-4-8-9(11-6(5)2)12-7(3)13-10(8)14/h4H,1-3H3,(H,11,12,13,14)
InChIKeyXGFONEYUHGRYFH-UHFFFAOYSA-N
MW189.22 g/mol
LogP1.24
Rot. Bonds

About 2,6,7-trimethyl-3H-pyrido[2,3-d]pyrimidin-4-one

2,6,7-trimethyl-3H-pyrido[2,3-d]pyrimidin-4-one (PubChem CID 137292833) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is 2,6,7-trimethyl-3H-pyrido[2,3-d]pyrimidin-4-one.

Molecular Properties

Compound Name2,6,7-trimethyl-3H-pyrido[2,3-d]pyrimidin-4-one
PubChem CID137292833
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name2,6,7-trimethyl-3H-pyrido[2,3-d]pyrimidin-4-one
SMILESCc1nc2nc(C)c(C)cc2c(=O)[nH]1
InChIInChI=1S/C10H11N3O/c1-5-4-8-9(11-6(5)2)12-7(3)13-10(8)14/h4H,1-3H3,(H,11,12,13,14)
InChIKeyXGFONEYUHGRYFH-UHFFFAOYSA-N
XLogP1.24
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,6,7-trimethyl-3H-pyrido[2,3-d]pyrimidin-4-one?
The IUPAC name of 2,6,7-trimethyl-3H-pyrido[2,3-d]pyrimidin-4-one (CID 137292833) is 2,6,7-trimethyl-3H-pyrido[2,3-d]pyrimidin-4-one.
What is the SMILES notation for 2,6,7-trimethyl-3H-pyrido[2,3-d]pyrimidin-4-one?
The canonical SMILES for 2,6,7-trimethyl-3H-pyrido[2,3-d]pyrimidin-4-one is Cc1nc2nc(C)c(C)cc2c(=O)[nH]1.
What is the InChIKey of 2,6,7-trimethyl-3H-pyrido[2,3-d]pyrimidin-4-one?
The InChIKey is XGFONEYUHGRYFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c1-5-4-8-9(11-6(5)2)12-7(3)13-10(8)14/h4H,1-3H3,(H,11,12,13,14).
What are the key properties of 2,6,7-trimethyl-3H-pyrido[2,3-d]pyrimidin-4-one?
2,6,7-trimethyl-3H-pyrido[2,3-d]pyrimidin-4-one has a molecular weight of 189.22 g/mol, XLogP of 1.24, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6,7-trimethyl-3H-pyrido[2,3-d]pyrimidin-4-one is sourced from PubChem (CID 137292833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).