N-(3-chloro-2H-indazol-5-yl)-1,6-dimethyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxamide

C22H18ClF3N4O2 — CID 11328719

IUPACN-(3-chloro-2H-indazol-5-yl)-1,6-dimethyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxamide
SMILESCC1=C(C(=O)Nc2ccc3n[nH]c(Cl)c3c2)C(c2ccc(C(F)(F)F)cc2)CC(=O)N1C
InChIInChI=1S/C22H18ClF3N4O2/c1-11-19(21(32)27-14-7-8-17-16(9-14)20(23)29-28-17)15(10-18(31)30(11)2)12-3-5-13(6-4-12)22(24,25)26/h3-9,15H,10H2,1-2H3,(H,27,32)(H,28,29)
InChIKeyLDFINSNXCDIJMM-UHFFFAOYSA-N
MW462.86 g/mol
LogP5.09
Rot. Bonds3

About N-(3-chloro-2H-indazol-5-yl)-1,6-dimethyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxamide

N-(3-chloro-2H-indazol-5-yl)-1,6-dimethyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxamide (PubChem CID 11328719) has the molecular formula C22H18ClF3N4O2 and a molecular weight of 462.86 g/mol. Its IUPAC name is N-(3-chloro-2H-indazol-5-yl)-1,6-dimethyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-2H-indazol-5-yl)-1,6-dimethyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxamide
PubChem CID11328719
Molecular FormulaC22H18ClF3N4O2
Molecular Weight462.86 g/mol
Exact Mass462.11
IUPAC NameN-(3-chloro-2H-indazol-5-yl)-1,6-dimethyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxamide
SMILESCC1=C(C(=O)Nc2ccc3n[nH]c(Cl)c3c2)C(c2ccc(C(F)(F)F)cc2)CC(=O)N1C
InChIInChI=1S/C22H18ClF3N4O2/c1-11-19(21(32)27-14-7-8-17-16(9-14)20(23)29-28-17)15(10-18(31)30(11)2)12-3-5-13(6-4-12)22(24,25)26/h3-9,15H,10H2,1-2H3,(H,27,32)(H,28,29)
InChIKeyLDFINSNXCDIJMM-UHFFFAOYSA-N
XLogP5.09
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500462.86
LogP ≤ 55.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(3-chloro-2H-indazol-5-yl)-1,6-dimethyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxamide 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

4-(4-(trifluoromethyl)phenyl)-N-(6-fluoro-1H-indazol-5-yl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxamide
CID 11373846
Dihydropyridone indazole amide 10
CID 11189172
4-(3,4-dichlorophenyl)-N-1H-indazol-5-yl-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxamide
CID 11247002
4-(4-fluorophenyl)-N-1H-indazol-5-yl-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxamide
CID 11360518
Dihydropyridone indazole amide 13
CID 11453116
N-(7-chloro-1H-indazol-5-yl)-6-methyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-3,4-dihydro-1H-pyridine-5-carboxamide
CID 11751266
4-Fluoro-N-[3-(1-methyl-piperidin-4-yl)-1H-indazol-5-yl]-benzamide
CID 9950390
4-[4-chloro-3-(methanesulfonamido)phenyl]-N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxamide
CID 44529727
N-(4-fluoro-1H-indazol-5-yl)-2-methyl-6-oxo-4-[4-(trifluoromethyl)phenyl]-1,4,5,6-tetrahydropyridine-3-carboxamide
CID 16099866
N-[4-chloro-3-(trifluoromethyl)phenyl]-N'-[3-[4-(methylcarbamoyl)phenyl]-1H-indazol-6-yl]propanediamide
CID 155559402
6-[2-chloro-4-(3-methyl-2-oxo-1-pyridinyl)phenyl]-N-methyl-1H-indazole-3-carboxamide
CID 162645791
6-[2-chloro-4-(3-methyl-2-oxo-1-pyridinyl)phenyl]-N-ethyl-1H-indazole-3-carboxamide
CID 162650305

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2H-indazol-5-yl)-1,6-dimethyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxamide?
The IUPAC name of N-(3-chloro-2H-indazol-5-yl)-1,6-dimethyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxamide (CID 11328719) is N-(3-chloro-2H-indazol-5-yl)-1,6-dimethyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxamide.
What is the SMILES notation for N-(3-chloro-2H-indazol-5-yl)-1,6-dimethyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxamide?
The canonical SMILES for N-(3-chloro-2H-indazol-5-yl)-1,6-dimethyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxamide is CC1=C(C(=O)Nc2ccc3n[nH]c(Cl)c3c2)C(c2ccc(C(F)(F)F)cc2)CC(=O)N1C.
What is the InChIKey of N-(3-chloro-2H-indazol-5-yl)-1,6-dimethyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxamide?
The InChIKey is LDFINSNXCDIJMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18ClF3N4O2/c1-11-19(21(32)27-14-7-8-17-16(9-14)20(23)29-28-17)15(10-18(31)30(11)2)12-3-5-13(6-4-12)22(24,25)26/h3-9,15H,10H2,1-2H3,(H,27,32)(H,28,29).
What are the key properties of N-(3-chloro-2H-indazol-5-yl)-1,6-dimethyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxamide?
N-(3-chloro-2H-indazol-5-yl)-1,6-dimethyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxamide has a molecular weight of 462.86 g/mol, XLogP of 5.09, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2H-indazol-5-yl)-1,6-dimethyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxamide is sourced from PubChem (CID 11328719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).