2-(4-chlorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one

C15H11ClN2O — CID 5468912

IUPAC2-(4-chlorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one
SMILESCc1ccc2c(=O)cc(-c3ccc(Cl)cc3)[nH]c2n1
InChIInChI=1S/C15H11ClN2O/c1-9-2-7-12-14(19)8-13(18-15(12)17-9)10-3-5-11(16)6-4-10/h2-8H,1H3,(H,17,18,19)
InChIKeyRIVJLXUGNRBXCS-UHFFFAOYSA-N
MW270.72 g/mol
LogP3.55
Rot. Bonds1

About 2-(4-chlorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one

2-(4-chlorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one (PubChem CID 5468912) has the molecular formula C15H11ClN2O and a molecular weight of 270.72 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one.

Molecular Properties

Compound Name2-(4-chlorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one
PubChem CID5468912
Molecular FormulaC15H11ClN2O
Molecular Weight270.72 g/mol
Exact Mass270.06
IUPAC Name2-(4-chlorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one
SMILESCc1ccc2c(=O)cc(-c3ccc(Cl)cc3)[nH]c2n1
InChIInChI=1S/C15H11ClN2O/c1-9-2-7-12-14(19)8-13(18-15(12)17-9)10-3-5-11(16)6-4-10/h2-8H,1H3,(H,17,18,19)
InChIKeyRIVJLXUGNRBXCS-UHFFFAOYSA-N
XLogP3.55
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.72
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one?
The IUPAC name of 2-(4-chlorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one (CID 5468912) is 2-(4-chlorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one.
What is the SMILES notation for 2-(4-chlorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one?
The canonical SMILES for 2-(4-chlorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one is Cc1ccc2c(=O)cc(-c3ccc(Cl)cc3)[nH]c2n1.
What is the InChIKey of 2-(4-chlorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one?
The InChIKey is RIVJLXUGNRBXCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2O/c1-9-2-7-12-14(19)8-13(18-15(12)17-9)10-3-5-11(16)6-4-10/h2-8H,1H3,(H,17,18,19).
What are the key properties of 2-(4-chlorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one?
2-(4-chlorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one has a molecular weight of 270.72 g/mol, XLogP of 3.55, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one is sourced from PubChem (CID 5468912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).