1-(2-chloro-4-methoxyphenyl)-6-cyclopropyl-N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-2-oxopyridine-3-carboxamide

C32H26ClFN4O6 — CID 177004588

IUPAC1-(2-chloro-4-methoxyphenyl)-6-cyclopropyl-N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-2-oxopyridine-3-carboxamide
SMILESCOc1ccc(-n2c(C3CC3)ccc(C(=O)Nc3ccc(Oc4ccnc5cc(OC)c(OC)nc45)c(F)c3)c2=O)c(Cl)c1
InChIInChI=1S/C32H26ClFN4O6/c1-41-19-7-9-25(21(33)15-19)38-24(17-4-5-17)10-8-20(32(38)40)30(39)36-18-6-11-26(22(34)14-18)44-27-12-13-35-23-16-28(42-2)31(43-3)37-29(23)27/h6-17H,4-5H2,1-3H3,(H,36,39)
InChIKeyUBTNIEUEVVXHNE-UHFFFAOYSA-N
MW617.03 g/mol
LogP6.52
Rot. Bonds9

About 1-(2-chloro-4-methoxyphenyl)-6-cyclopropyl-N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-2-oxopyridine-3-carboxamide

1-(2-chloro-4-methoxyphenyl)-6-cyclopropyl-N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-2-oxopyridine-3-carboxamide (PubChem CID 177004588) has the molecular formula C32H26ClFN4O6 and a molecular weight of 617.03 g/mol. Its IUPAC name is 1-(2-chloro-4-methoxyphenyl)-6-cyclopropyl-N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-(2-chloro-4-methoxyphenyl)-6-cyclopropyl-N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-2-oxopyridine-3-carboxamide
PubChem CID177004588
Molecular FormulaC32H26ClFN4O6
Molecular Weight617.03 g/mol
Exact Mass616.15
IUPAC Name1-(2-chloro-4-methoxyphenyl)-6-cyclopropyl-N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-2-oxopyridine-3-carboxamide
SMILESCOc1ccc(-n2c(C3CC3)ccc(C(=O)Nc3ccc(Oc4ccnc5cc(OC)c(OC)nc45)c(F)c3)c2=O)c(Cl)c1
InChIInChI=1S/C32H26ClFN4O6/c1-41-19-7-9-25(21(33)15-19)38-24(17-4-5-17)10-8-20(32(38)40)30(39)36-18-6-11-26(22(34)14-18)44-27-12-13-35-23-16-28(42-2)31(43-3)37-29(23)27/h6-17H,4-5H2,1-3H3,(H,36,39)
InChIKeyUBTNIEUEVVXHNE-UHFFFAOYSA-N
XLogP6.52
TPSA113.80 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds9
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500617.03
LogP ≤ 56.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze 1-(2-chloro-4-methoxyphenyl)-6-cyclopropyl-N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-2-oxopyridine-3-carboxamide with MolForge

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Related Compounds

1-(2-chloro-4-methoxyphenyl)-N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide
CID 177004449
1-(2-chloro-4-methoxyphenyl)-N-[6-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-5-fluoro-3-pyridinyl]-2-oxo-6-(trifluoromethyl)pyridine-3-carboxamide
CID 177004597
5-cyclopentyl-N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-1,6-dimethyl-4-oxopyridine-3-carboxamide
CID 164905096
N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-2-oxo-1-(2-oxo-1H-pyridin-4-yl)pyridine-3-carboxamide
CID 156841203
5-N-cyclopropyl-3-N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-2,6-dimethyl-4-oxo-1H-pyridine-3,5-dicarboxamide
CID 164904962
6-cyclopropyl-N-[3-fluoro-4-(3-fluoro-6,7-dimethoxyquinolin-4-yl)oxyphenyl]-1-(4-methyl-6-oxo-1H-pyridin-3-yl)-2-oxopyridine-3-carboxamide
CID 177004471
N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-5-fluoro-1-(4-fluorophenyl)-4-methyl-2-oxopyridine-3-carboxamide
CID 165373132
N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-5-(furan-3-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 156840982
6-cyclopropyl-N-[4-(6,7-dimethoxyquinolin-4-yl)sulfanyl-3-fluorophenyl]-1-(6-methoxy-4-methyl-3-pyridinyl)-2-oxopyridine-3-carboxamide
CID 177004458
N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-2,6-dimethyl-4-oxo-5-propan-2-yl-1H-pyridine-3-carboxamide
CID 164905012
5-cyclopropyl-N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-2,5-difluorophenyl]-1,2,6-trimethyl-4-oxopyridine-3-carboxamide
CID 164904978
5-cyclopropyl-N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-fluorophenyl]-1-phenylpyrazole-3-carboxamide
CID 177251203

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-4-methoxyphenyl)-6-cyclopropyl-N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-2-oxopyridine-3-carboxamide?
The IUPAC name of 1-(2-chloro-4-methoxyphenyl)-6-cyclopropyl-N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-2-oxopyridine-3-carboxamide (CID 177004588) is 1-(2-chloro-4-methoxyphenyl)-6-cyclopropyl-N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-2-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-(2-chloro-4-methoxyphenyl)-6-cyclopropyl-N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-2-oxopyridine-3-carboxamide?
The canonical SMILES for 1-(2-chloro-4-methoxyphenyl)-6-cyclopropyl-N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-2-oxopyridine-3-carboxamide is COc1ccc(-n2c(C3CC3)ccc(C(=O)Nc3ccc(Oc4ccnc5cc(OC)c(OC)nc45)c(F)c3)c2=O)c(Cl)c1.
What is the InChIKey of 1-(2-chloro-4-methoxyphenyl)-6-cyclopropyl-N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-2-oxopyridine-3-carboxamide?
The InChIKey is UBTNIEUEVVXHNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H26ClFN4O6/c1-41-19-7-9-25(21(33)15-19)38-24(17-4-5-17)10-8-20(32(38)40)30(39)36-18-6-11-26(22(34)14-18)44-27-12-13-35-23-16-28(42-2)31(43-3)37-29(23)27/h6-17H,4-5H2,1-3H3,(H,36,39).
What are the key properties of 1-(2-chloro-4-methoxyphenyl)-6-cyclopropyl-N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-2-oxopyridine-3-carboxamide?
1-(2-chloro-4-methoxyphenyl)-6-cyclopropyl-N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-2-oxopyridine-3-carboxamide has a molecular weight of 617.03 g/mol, XLogP of 6.52, 9 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-4-methoxyphenyl)-6-cyclopropyl-N-[4-[(6,7-dimethoxy-1,5-naphthyridin-4-yl)oxy]-3-fluorophenyl]-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 177004588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).