7-chloro-4-hydroxy-3-(3-methoxyphenyl)-1H-1,5-naphthyridin-2-one

C15H11ClN2O3 — CID 54730154

IUPAC7-chloro-4-hydroxy-3-(3-methoxyphenyl)-1H-1,5-naphthyridin-2-one
SMILESCOc1cccc(-c2c(O)c3ncc(Cl)cc3[nH]c2=O)c1
InChIInChI=1S/C15H11ClN2O3/c1-21-10-4-2-3-8(5-10)12-14(19)13-11(18-15(12)20)6-9(16)7-17-13/h2-7H,1H3,(H2,18,19,20)
InChIKeyASCXKRMXEFOMII-UHFFFAOYSA-N
MW302.72 g/mol
LogP2.96
Rot. Bonds2

About 7-chloro-4-hydroxy-3-(3-methoxyphenyl)-1H-1,5-naphthyridin-2-one

7-chloro-4-hydroxy-3-(3-methoxyphenyl)-1H-1,5-naphthyridin-2-one (PubChem CID 54730154) has the molecular formula C15H11ClN2O3 and a molecular weight of 302.72 g/mol. Its IUPAC name is 7-chloro-4-hydroxy-3-(3-methoxyphenyl)-1H-1,5-naphthyridin-2-one.

Molecular Properties

Compound Name7-chloro-4-hydroxy-3-(3-methoxyphenyl)-1H-1,5-naphthyridin-2-one
PubChem CID54730154
Molecular FormulaC15H11ClN2O3
Molecular Weight302.72 g/mol
Exact Mass302.05
IUPAC Name7-chloro-4-hydroxy-3-(3-methoxyphenyl)-1H-1,5-naphthyridin-2-one
SMILESCOc1cccc(-c2c(O)c3ncc(Cl)cc3[nH]c2=O)c1
InChIInChI=1S/C15H11ClN2O3/c1-21-10-4-2-3-8(5-10)12-14(19)13-11(18-15(12)20)6-9(16)7-17-13/h2-7H,1H3,(H2,18,19,20)
InChIKeyASCXKRMXEFOMII-UHFFFAOYSA-N
XLogP2.96
TPSA75.21 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.72
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 7-chloro-4-hydroxy-3-(3-methoxyphenyl)-1H-1,5-naphthyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-chloro-4-hydroxy-3-(3-methoxyphenyl)-1H-1,5-naphthyridin-2-one?
The IUPAC name of 7-chloro-4-hydroxy-3-(3-methoxyphenyl)-1H-1,5-naphthyridin-2-one (CID 54730154) is 7-chloro-4-hydroxy-3-(3-methoxyphenyl)-1H-1,5-naphthyridin-2-one.
What is the SMILES notation for 7-chloro-4-hydroxy-3-(3-methoxyphenyl)-1H-1,5-naphthyridin-2-one?
The canonical SMILES for 7-chloro-4-hydroxy-3-(3-methoxyphenyl)-1H-1,5-naphthyridin-2-one is COc1cccc(-c2c(O)c3ncc(Cl)cc3[nH]c2=O)c1.
What is the InChIKey of 7-chloro-4-hydroxy-3-(3-methoxyphenyl)-1H-1,5-naphthyridin-2-one?
The InChIKey is ASCXKRMXEFOMII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2O3/c1-21-10-4-2-3-8(5-10)12-14(19)13-11(18-15(12)20)6-9(16)7-17-13/h2-7H,1H3,(H2,18,19,20).
What are the key properties of 7-chloro-4-hydroxy-3-(3-methoxyphenyl)-1H-1,5-naphthyridin-2-one?
7-chloro-4-hydroxy-3-(3-methoxyphenyl)-1H-1,5-naphthyridin-2-one has a molecular weight of 302.72 g/mol, XLogP of 2.96, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-4-hydroxy-3-(3-methoxyphenyl)-1H-1,5-naphthyridin-2-one is sourced from PubChem (CID 54730154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).