2-methyl-N-[4-(methylamino)-2-oxo-1-pyridin-3-yl-7-(trifluoromethyl)-1,8-naphthyridin-3-yl]indazole-5-carboxamide

C24H18F3N7O2 — CID 170551431

IUPAC2-methyl-N-[4-(methylamino)-2-oxo-1-pyridin-3-yl-7-(trifluoromethyl)-1,8-naphthyridin-3-yl]indazole-5-carboxamide
SMILESCNc1c(NC(=O)c2ccc3nn(C)cc3c2)c(=O)n(-c2cccnc2)c2nc(C(F)(F)F)ccc12
InChIInChI=1S/C24H18F3N7O2/c1-28-19-16-6-8-18(24(25,26)27)30-21(16)34(15-4-3-9-29-11-15)23(36)20(19)31-22(35)13-5-7-17-14(10-13)12-33(2)32-17/h3-12,28H,1-2H3,(H,31,35)
InChIKeyOKJIBQZNLVMJKG-UHFFFAOYSA-N
MW493.45 g/mol
LogP3.98
Rot. Bonds4

About 2-methyl-N-[4-(methylamino)-2-oxo-1-pyridin-3-yl-7-(trifluoromethyl)-1,8-naphthyridin-3-yl]indazole-5-carboxamide

2-methyl-N-[4-(methylamino)-2-oxo-1-pyridin-3-yl-7-(trifluoromethyl)-1,8-naphthyridin-3-yl]indazole-5-carboxamide (PubChem CID 170551431) has the molecular formula C24H18F3N7O2 and a molecular weight of 493.45 g/mol. Its IUPAC name is 2-methyl-N-[4-(methylamino)-2-oxo-1-pyridin-3-yl-7-(trifluoromethyl)-1,8-naphthyridin-3-yl]indazole-5-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[4-(methylamino)-2-oxo-1-pyridin-3-yl-7-(trifluoromethyl)-1,8-naphthyridin-3-yl]indazole-5-carboxamide
PubChem CID170551431
Molecular FormulaC24H18F3N7O2
Molecular Weight493.45 g/mol
Exact Mass493.15
IUPAC Name2-methyl-N-[4-(methylamino)-2-oxo-1-pyridin-3-yl-7-(trifluoromethyl)-1,8-naphthyridin-3-yl]indazole-5-carboxamide
SMILESCNc1c(NC(=O)c2ccc3nn(C)cc3c2)c(=O)n(-c2cccnc2)c2nc(C(F)(F)F)ccc12
InChIInChI=1S/C24H18F3N7O2/c1-28-19-16-6-8-18(24(25,26)27)30-21(16)34(15-4-3-9-29-11-15)23(36)20(19)31-22(35)13-5-7-17-14(10-13)12-33(2)32-17/h3-12,28H,1-2H3,(H,31,35)
InChIKeyOKJIBQZNLVMJKG-UHFFFAOYSA-N
XLogP3.98
TPSA106.73 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500493.45
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

4-(methylamino)-3-nitro-1-pyridin-3-yl-7-(trifluoromethyl)-1,8-naphthyridin-2-one
CID 175490444
3-[2-methyl-4-oxo-7-(trifluoromethyl)pyrazolo[3,4-c][1,8]naphthyridin-5-yl]benzoic acid
CID 172525517
7-ethoxy-3-(2-methylindazol-5-yl)-1-[6-(trifluoromethyl)-3-pyridinyl]-1,8-naphthyridin-2-one
CID 155343700
N-[2-(4-amino-2-oxopyrimidin-1-yl)ethyl]-2-pyridin-3-ylindazole-5-carboxamide
CID 167254941
2-pyridin-3-yl-N-(pyridin-2-ylmethyl)indazole-5-carboxamide
CID 167431659
N-[2-[4-[2-(trifluoromethyl)-1,6-naphthyridin-5-yl]piperazin-1-yl]ethyl]pyridine-3-carboxamide
CID 24735489
6-fluoro-2-methyl-3-pyridin-3-ylquinazolin-4-one
CID 134445912
N-[3-oxo-2-[3-(trifluoromethyl)phenyl]-1H-isoindol-4-yl]pyridine-3-carboxamide
CID 58578211
N-[2-methyl-3-(4-methylphenyl)-4-oxoquinazolin-6-yl]pyridine-3-carboxamide
CID 30867406
N-[6-(2-hydroxypropan-2-yl)-2-methylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 138727771
4-methyl-3-(1-pyridin-3-ylaziridin-2-yl)-N-[3-(trifluoromethyl)phenyl]benzamide
CID 170156523
N-[4-methyl-3-(2-methyl-6-pyridin-3-ylpyrazolo[3,4-d]pyrimidin-4-yl)oxyphenyl]-3-(trifluoromethyl)benzamide
CID 146556145

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[4-(methylamino)-2-oxo-1-pyridin-3-yl-7-(trifluoromethyl)-1,8-naphthyridin-3-yl]indazole-5-carboxamide?
The IUPAC name of 2-methyl-N-[4-(methylamino)-2-oxo-1-pyridin-3-yl-7-(trifluoromethyl)-1,8-naphthyridin-3-yl]indazole-5-carboxamide (CID 170551431) is 2-methyl-N-[4-(methylamino)-2-oxo-1-pyridin-3-yl-7-(trifluoromethyl)-1,8-naphthyridin-3-yl]indazole-5-carboxamide.
What is the SMILES notation for 2-methyl-N-[4-(methylamino)-2-oxo-1-pyridin-3-yl-7-(trifluoromethyl)-1,8-naphthyridin-3-yl]indazole-5-carboxamide?
The canonical SMILES for 2-methyl-N-[4-(methylamino)-2-oxo-1-pyridin-3-yl-7-(trifluoromethyl)-1,8-naphthyridin-3-yl]indazole-5-carboxamide is CNc1c(NC(=O)c2ccc3nn(C)cc3c2)c(=O)n(-c2cccnc2)c2nc(C(F)(F)F)ccc12.
What is the InChIKey of 2-methyl-N-[4-(methylamino)-2-oxo-1-pyridin-3-yl-7-(trifluoromethyl)-1,8-naphthyridin-3-yl]indazole-5-carboxamide?
The InChIKey is OKJIBQZNLVMJKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18F3N7O2/c1-28-19-16-6-8-18(24(25,26)27)30-21(16)34(15-4-3-9-29-11-15)23(36)20(19)31-22(35)13-5-7-17-14(10-13)12-33(2)32-17/h3-12,28H,1-2H3,(H,31,35).
What are the key properties of 2-methyl-N-[4-(methylamino)-2-oxo-1-pyridin-3-yl-7-(trifluoromethyl)-1,8-naphthyridin-3-yl]indazole-5-carboxamide?
2-methyl-N-[4-(methylamino)-2-oxo-1-pyridin-3-yl-7-(trifluoromethyl)-1,8-naphthyridin-3-yl]indazole-5-carboxamide has a molecular weight of 493.45 g/mol, XLogP of 3.98, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[4-(methylamino)-2-oxo-1-pyridin-3-yl-7-(trifluoromethyl)-1,8-naphthyridin-3-yl]indazole-5-carboxamide is sourced from PubChem (CID 170551431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).