7-(4-fluoro-2-methyl-1H-indol-5-yl)-2,3-dimethoxy-1,7-naphthyridin-8-one

C19H16FN3O3 — CID 175939008

IUPAC7-(4-fluoro-2-methyl-1H-indol-5-yl)-2,3-dimethoxy-1,7-naphthyridin-8-one
SMILESCOc1cc2ccn(-c3ccc4[nH]c(C)cc4c3F)c(=O)c2nc1OC
InChIInChI=1S/C19H16FN3O3/c1-10-8-12-13(21-10)4-5-14(16(12)20)23-7-6-11-9-15(25-2)18(26-3)22-17(11)19(23)24/h4-9,21H,1-3H3
InChIKeyDPWNVNJYCJVDCD-UHFFFAOYSA-N
MW353.35 g/mol
LogP3.33
Rot. Bonds3

About 7-(4-fluoro-2-methyl-1H-indol-5-yl)-2,3-dimethoxy-1,7-naphthyridin-8-one

7-(4-fluoro-2-methyl-1H-indol-5-yl)-2,3-dimethoxy-1,7-naphthyridin-8-one (PubChem CID 175939008) has the molecular formula C19H16FN3O3 and a molecular weight of 353.35 g/mol. Its IUPAC name is 7-(4-fluoro-2-methyl-1H-indol-5-yl)-2,3-dimethoxy-1,7-naphthyridin-8-one.

Molecular Properties

Compound Name7-(4-fluoro-2-methyl-1H-indol-5-yl)-2,3-dimethoxy-1,7-naphthyridin-8-one
PubChem CID175939008
Molecular FormulaC19H16FN3O3
Molecular Weight353.35 g/mol
Exact Mass353.12
IUPAC Name7-(4-fluoro-2-methyl-1H-indol-5-yl)-2,3-dimethoxy-1,7-naphthyridin-8-one
SMILESCOc1cc2ccn(-c3ccc4[nH]c(C)cc4c3F)c(=O)c2nc1OC
InChIInChI=1S/C19H16FN3O3/c1-10-8-12-13(21-10)4-5-14(16(12)20)23-7-6-11-9-15(25-2)18(26-3)22-17(11)19(23)24/h4-9,21H,1-3H3
InChIKeyDPWNVNJYCJVDCD-UHFFFAOYSA-N
XLogP3.33
TPSA69.14 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.35
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 7-(4-fluoro-2-methyl-1H-indol-5-yl)-2,3-dimethoxy-1,7-naphthyridin-8-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-(4-fluoro-2-methyl-1H-indol-5-yl)-2,3-dimethoxy-1,7-naphthyridin-8-one?
The IUPAC name of 7-(4-fluoro-2-methyl-1H-indol-5-yl)-2,3-dimethoxy-1,7-naphthyridin-8-one (CID 175939008) is 7-(4-fluoro-2-methyl-1H-indol-5-yl)-2,3-dimethoxy-1,7-naphthyridin-8-one.
What is the SMILES notation for 7-(4-fluoro-2-methyl-1H-indol-5-yl)-2,3-dimethoxy-1,7-naphthyridin-8-one?
The canonical SMILES for 7-(4-fluoro-2-methyl-1H-indol-5-yl)-2,3-dimethoxy-1,7-naphthyridin-8-one is COc1cc2ccn(-c3ccc4[nH]c(C)cc4c3F)c(=O)c2nc1OC.
What is the InChIKey of 7-(4-fluoro-2-methyl-1H-indol-5-yl)-2,3-dimethoxy-1,7-naphthyridin-8-one?
The InChIKey is DPWNVNJYCJVDCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN3O3/c1-10-8-12-13(21-10)4-5-14(16(12)20)23-7-6-11-9-15(25-2)18(26-3)22-17(11)19(23)24/h4-9,21H,1-3H3.
What are the key properties of 7-(4-fluoro-2-methyl-1H-indol-5-yl)-2,3-dimethoxy-1,7-naphthyridin-8-one?
7-(4-fluoro-2-methyl-1H-indol-5-yl)-2,3-dimethoxy-1,7-naphthyridin-8-one has a molecular weight of 353.35 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-fluoro-2-methyl-1H-indol-5-yl)-2,3-dimethoxy-1,7-naphthyridin-8-one is sourced from PubChem (CID 175939008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).