7-chloro-6-fluoro-1-(4-methoxyphenyl)-4-(methylamino)-3-(2-methylindazol-5-yl)-1,8-naphthyridin-2-one

C24H19ClFN5O2 — CID 176913568

IUPAC7-chloro-6-fluoro-1-(4-methoxyphenyl)-4-(methylamino)-3-(2-methylindazol-5-yl)-1,8-naphthyridin-2-one
SMILESCNc1c(-c2ccc3nn(C)cc3c2)c(=O)n(-c2ccc(OC)cc2)c2nc(Cl)c(F)cc12
InChIInChI=1S/C24H19ClFN5O2/c1-27-21-17-11-18(26)22(25)28-23(17)31(15-5-7-16(33-3)8-6-15)24(32)20(21)13-4-9-19-14(10-13)12-30(2)29-19/h4-12,27H,1-3H3
InChIKeyPDPHGOLKSRVJJJ-UHFFFAOYSA-N
MW463.90 g/mol
LogP4.78
Rot. Bonds4

About 7-chloro-6-fluoro-1-(4-methoxyphenyl)-4-(methylamino)-3-(2-methylindazol-5-yl)-1,8-naphthyridin-2-one

7-chloro-6-fluoro-1-(4-methoxyphenyl)-4-(methylamino)-3-(2-methylindazol-5-yl)-1,8-naphthyridin-2-one (PubChem CID 176913568) has the molecular formula C24H19ClFN5O2 and a molecular weight of 463.90 g/mol. Its IUPAC name is 7-chloro-6-fluoro-1-(4-methoxyphenyl)-4-(methylamino)-3-(2-methylindazol-5-yl)-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name7-chloro-6-fluoro-1-(4-methoxyphenyl)-4-(methylamino)-3-(2-methylindazol-5-yl)-1,8-naphthyridin-2-one
PubChem CID176913568
Molecular FormulaC24H19ClFN5O2
Molecular Weight463.90 g/mol
Exact Mass463.12
IUPAC Name7-chloro-6-fluoro-1-(4-methoxyphenyl)-4-(methylamino)-3-(2-methylindazol-5-yl)-1,8-naphthyridin-2-one
SMILESCNc1c(-c2ccc3nn(C)cc3c2)c(=O)n(-c2ccc(OC)cc2)c2nc(Cl)c(F)cc12
InChIInChI=1S/C24H19ClFN5O2/c1-27-21-17-11-18(26)22(25)28-23(17)31(15-5-7-16(33-3)8-6-15)24(32)20(21)13-4-9-19-14(10-13)12-30(2)29-19/h4-12,27H,1-3H3
InChIKeyPDPHGOLKSRVJJJ-UHFFFAOYSA-N
XLogP4.78
TPSA73.97 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500463.90
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 7-chloro-6-fluoro-1-(4-methoxyphenyl)-4-(methylamino)-3-(2-methylindazol-5-yl)-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

Related Compounds

5-(4-methoxyphenyl)-2-methyl-7-(trifluoromethyl)pyrazolo[3,4-c][1,8]naphthyridin-4-one
CID 172525423
1-[4-(difluoromethoxy)phenyl]-3-(4-methoxyphenyl)-4-(methylamino)-7-(trifluoromethyl)-1,5-naphthyridin-2-one
CID 177182194
6-(3,4-difluorophenyl)-8-(4-methoxyphenyl)pteridin-7-one
CID 3234422
4-[4-(difluoromethoxy)phenyl]-2-ethoxy-6-[2-(trideuteriomethyl)indazol-5-yl]-[1,3]thiazolo[4,5-b]pyridin-5-one
CID 175731285
3-chloro-5-[4-(difluoromethoxy)phenyl]-7-(4-methoxyphenyl)pyrido[2,3-b]pyrazin-6-one
CID 155343664
7-ethoxy-1-[6-(ethylamino)-3-pyridinyl]-3-(2-methylindazol-5-yl)-1,8-naphthyridin-2-one
CID 155347900
2-methyl-N-[4-(methylamino)-2-oxo-1-pyridin-3-yl-7-(trifluoromethyl)-1,8-naphthyridin-3-yl]indazole-5-carboxamide
CID 170551431
8-(4-chlorophenyl)-6-(4-methoxyphenyl)-2-(2,2,2-trifluoroethylamino)pyrido[2,3-d]pyrimidin-7-one
CID 155347843
1-(3-chloro-4-fluorophenyl)-3-(4-methoxyphenyl)pyrazole-5-carboxylic acid
CID 91871386
1-(4-chlorophenyl)-3-(2-methylindazol-5-yl)-7-(2,2,2-trifluoroethylamino)-4H-pyrimido[4,5-d]pyrimidin-2-one;1-[4-(difluoromethoxy)phenyl]-7-(ethylamino)-3-(2-methylindazol-5-yl)-4H-pyrido[2,3-d]pyrimidin-2-one;1-[4-(difluoromethoxy)phenyl]-3-(2-methylindazol-5-yl)-7-(2,2,2-trifluoroethylamino)-4H-pyrido[2,3-d]pyrimidin-2-one;1-(4-hydroxyphenyl)-3-(4-methoxyphenyl)-7-(2,2,2-trifluoroethylamino)pyrimido[4,5-d]pyrimidine-2,4-dione
CID 165071183
1-(4-chlorophenyl)-6,7-dimethoxy-2-(4-methoxyphenyl)isoquinolin-3-one
CID 134912702
8-(4-chlorophenyl)-2-cyclopropyloxy-6-(2-methylindazol-5-yl)-1,6-naphthyridin-7-one
CID 139551966

Frequently Asked Questions

What is the IUPAC name of 7-chloro-6-fluoro-1-(4-methoxyphenyl)-4-(methylamino)-3-(2-methylindazol-5-yl)-1,8-naphthyridin-2-one?
The IUPAC name of 7-chloro-6-fluoro-1-(4-methoxyphenyl)-4-(methylamino)-3-(2-methylindazol-5-yl)-1,8-naphthyridin-2-one (CID 176913568) is 7-chloro-6-fluoro-1-(4-methoxyphenyl)-4-(methylamino)-3-(2-methylindazol-5-yl)-1,8-naphthyridin-2-one.
What is the SMILES notation for 7-chloro-6-fluoro-1-(4-methoxyphenyl)-4-(methylamino)-3-(2-methylindazol-5-yl)-1,8-naphthyridin-2-one?
The canonical SMILES for 7-chloro-6-fluoro-1-(4-methoxyphenyl)-4-(methylamino)-3-(2-methylindazol-5-yl)-1,8-naphthyridin-2-one is CNc1c(-c2ccc3nn(C)cc3c2)c(=O)n(-c2ccc(OC)cc2)c2nc(Cl)c(F)cc12.
What is the InChIKey of 7-chloro-6-fluoro-1-(4-methoxyphenyl)-4-(methylamino)-3-(2-methylindazol-5-yl)-1,8-naphthyridin-2-one?
The InChIKey is PDPHGOLKSRVJJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19ClFN5O2/c1-27-21-17-11-18(26)22(25)28-23(17)31(15-5-7-16(33-3)8-6-15)24(32)20(21)13-4-9-19-14(10-13)12-30(2)29-19/h4-12,27H,1-3H3.
What are the key properties of 7-chloro-6-fluoro-1-(4-methoxyphenyl)-4-(methylamino)-3-(2-methylindazol-5-yl)-1,8-naphthyridin-2-one?
7-chloro-6-fluoro-1-(4-methoxyphenyl)-4-(methylamino)-3-(2-methylindazol-5-yl)-1,8-naphthyridin-2-one has a molecular weight of 463.90 g/mol, XLogP of 4.78, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-6-fluoro-1-(4-methoxyphenyl)-4-(methylamino)-3-(2-methylindazol-5-yl)-1,8-naphthyridin-2-one is sourced from PubChem (CID 176913568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).