4-chloro-1-(2-chlorophenyl)-7-(trifluoromethyl)-1,8-naphthyridin-2-one

C15H7Cl2F3N2O — CID 162518394

IUPAC4-chloro-1-(2-chlorophenyl)-7-(trifluoromethyl)-1,8-naphthyridin-2-one
SMILESO=c1cc(Cl)c2ccc(C(F)(F)F)nc2n1-c1ccccc1Cl
InChIInChI=1S/C15H7Cl2F3N2O/c16-9-3-1-2-4-11(9)22-13(23)7-10(17)8-5-6-12(15(18,19)20)21-14(8)22/h1-7H
InChIKeyCGNFVRLJJJCRPF-UHFFFAOYSA-N
MW359.13 g/mol
LogP4.71
Rot. Bonds1

About 4-chloro-1-(2-chlorophenyl)-7-(trifluoromethyl)-1,8-naphthyridin-2-one

4-chloro-1-(2-chlorophenyl)-7-(trifluoromethyl)-1,8-naphthyridin-2-one (PubChem CID 162518394) has the molecular formula C15H7Cl2F3N2O and a molecular weight of 359.13 g/mol. Its IUPAC name is 4-chloro-1-(2-chlorophenyl)-7-(trifluoromethyl)-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name4-chloro-1-(2-chlorophenyl)-7-(trifluoromethyl)-1,8-naphthyridin-2-one
PubChem CID162518394
Molecular FormulaC15H7Cl2F3N2O
Molecular Weight359.13 g/mol
Exact Mass357.99
IUPAC Name4-chloro-1-(2-chlorophenyl)-7-(trifluoromethyl)-1,8-naphthyridin-2-one
SMILESO=c1cc(Cl)c2ccc(C(F)(F)F)nc2n1-c1ccccc1Cl
InChIInChI=1S/C15H7Cl2F3N2O/c16-9-3-1-2-4-11(9)22-13(23)7-10(17)8-5-6-12(15(18,19)20)21-14(8)22/h1-7H
InChIKeyCGNFVRLJJJCRPF-UHFFFAOYSA-N
XLogP4.71
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.13
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-chloro-1-(2-chlorophenyl)-7-(trifluoromethyl)-1,8-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 4-chloro-1-(2-chlorophenyl)-7-(trifluoromethyl)-1,8-naphthyridin-2-one?
The IUPAC name of 4-chloro-1-(2-chlorophenyl)-7-(trifluoromethyl)-1,8-naphthyridin-2-one (CID 162518394) is 4-chloro-1-(2-chlorophenyl)-7-(trifluoromethyl)-1,8-naphthyridin-2-one.
What is the SMILES notation for 4-chloro-1-(2-chlorophenyl)-7-(trifluoromethyl)-1,8-naphthyridin-2-one?
The canonical SMILES for 4-chloro-1-(2-chlorophenyl)-7-(trifluoromethyl)-1,8-naphthyridin-2-one is O=c1cc(Cl)c2ccc(C(F)(F)F)nc2n1-c1ccccc1Cl.
What is the InChIKey of 4-chloro-1-(2-chlorophenyl)-7-(trifluoromethyl)-1,8-naphthyridin-2-one?
The InChIKey is CGNFVRLJJJCRPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H7Cl2F3N2O/c16-9-3-1-2-4-11(9)22-13(23)7-10(17)8-5-6-12(15(18,19)20)21-14(8)22/h1-7H.
What are the key properties of 4-chloro-1-(2-chlorophenyl)-7-(trifluoromethyl)-1,8-naphthyridin-2-one?
4-chloro-1-(2-chlorophenyl)-7-(trifluoromethyl)-1,8-naphthyridin-2-one has a molecular weight of 359.13 g/mol, XLogP of 4.71, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-1-(2-chlorophenyl)-7-(trifluoromethyl)-1,8-naphthyridin-2-one is sourced from PubChem (CID 162518394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).