4-chloro-3-(1,1-difluoroethyl)-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-5-carboxamide;4-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide

C51H39Cl3F14N14O3 — CID 159306088

IUPAC4-chloro-3-(1,1-difluoroethyl)-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-5-carboxamide;4-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide
SMILESCn1cc(Cl)c(C(=O)Nc2ccc(-c3cc(C(F)(F)F)nn3C)c(F)c2)n1.Cn1ccc(Cl)c1C(=O)Nc1ccc(-c2cc(C(F)(F)F)nn2C)c(F)c1.Cn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)c2c(Cl)c(C(C)(F)F)nn2C)cc1F
InChIInChI=1S/C18H14ClF6N5O.C17H13ClF4N4O.C16H12ClF4N5O/c1-17(21,22)15-13(19)14(30(3)28-15)16(31)26-8-4-5-9(10(20)6-8)11-7-12(18(23,24)25)27-29(11)2;1-25-6-5-11(18)15(25)16(27)23-9-3-4-10(12(19)7-9)13-8-14(17(20,21)22)24-26(13)2;1-25-7-10(17)14(24-25)15(27)22-8-3-4-9(11(18)5-8)12-6-13(16(19,20)21)23-26(12)2/h4-7H,1-3H3,(H,26,31);3-8H,1-2H3,(H,23,27);3-7H,1-2H3,(H,22,27)
InChIKeyLBXYNMITSXUKSX-UHFFFAOYSA-N
MW1268.30 g/mol
LogP13.37
Rot. Bonds10

About 4-chloro-3-(1,1-difluoroethyl)-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-5-carboxamide;4-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide

4-chloro-3-(1,1-difluoroethyl)-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-5-carboxamide;4-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide (PubChem CID 159306088) has the molecular formula C51H39Cl3F14N14O3 and a molecular weight of 1268.30 g/mol. Its IUPAC name is 4-chloro-3-(1,1-difluoroethyl)-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-5-carboxamide;4-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide.

Molecular Properties

Compound Name4-chloro-3-(1,1-difluoroethyl)-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-5-carboxamide;4-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide
PubChem CID159306088
Molecular FormulaC51H39Cl3F14N14O3
Molecular Weight1268.30 g/mol
Exact Mass1266.22
IUPAC Name4-chloro-3-(1,1-difluoroethyl)-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-5-carboxamide;4-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide
SMILESCn1cc(Cl)c(C(=O)Nc2ccc(-c3cc(C(F)(F)F)nn3C)c(F)c2)n1.Cn1ccc(Cl)c1C(=O)Nc1ccc(-c2cc(C(F)(F)F)nn2C)c(F)c1.Cn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)c2c(Cl)c(C(C)(F)F)nn2C)cc1F
InChIInChI=1S/C18H14ClF6N5O.C17H13ClF4N4O.C16H12ClF4N5O/c1-17(21,22)15-13(19)14(30(3)28-15)16(31)26-8-4-5-9(10(20)6-8)11-7-12(18(23,24)25)27-29(11)2;1-25-6-5-11(18)15(25)16(27)23-9-3-4-10(12(19)7-9)13-8-14(17(20,21)22)24-26(13)2;1-25-7-10(17)14(24-25)15(27)22-8-3-4-9(11(18)5-8)12-6-13(16(19,20)21)23-26(12)2/h4-7H,1-3H3,(H,26,31);3-8H,1-2H3,(H,23,27);3-7H,1-2H3,(H,22,27)
InChIKeyLBXYNMITSXUKSX-UHFFFAOYSA-N
XLogP13.37
TPSA181.33 Ų
H-Bond Donors3
H-Bond Acceptors14
Rotatable Bonds10
Heavy Atoms85
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001268.30
LogP ≤ 513.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1014

Analyze 4-chloro-3-(1,1-difluoroethyl)-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-5-carboxamide;4-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-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

3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide
CID 90393634
3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1,4-dimethylpyrrole-2-carboxamide
CID 90393708
2-chloro-N-[2,3-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]phenyl]benzamide;N-[2,3-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]phenyl]-2,6-difluorobenzamide;bis(N-[2,3-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]phenyl]-2-fluorobenzamide);N-[2,3-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]phenyl]-2-fluoro-6-methylbenzamide;N-[2,3-difluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]phenyl]-2-methylbenzamide
CID 157216397
4-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide;N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide
CID 157400261
1-(3-chloro-4-fluorophenyl)-N,N-dimethyl-5-propan-2-ylpyrazole-3-carboxamide;1-(4-chloro-3-methylphenyl)-N-(1-methylpiperidin-4-yl)-5-propan-2-ylpyrazole-3-carboxamide;1,3-dimethyl-5-propan-2-ylpyrazole;1,5-di(propan-2-yl)-3-(trifluoromethyl)pyrazole;3-methyl-1,5-di(propan-2-yl)pyrazole;4-(3-methyl-5-propan-2-ylpyrazol-1-yl)pyridine;1-methyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole
CID 158717120
3-chloro-1-methyl-N-[4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]pyrrole-2-carboxamide
CID 159182906
4-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-3-carboxamide;3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline
CID 159415640
1-(4-chloro-3-methylphenyl)-N-(1-methylpiperidin-4-yl)-5-propan-2-ylpyrazole-3-carboxamide;1-(4-chlorophenyl)-N-methyl-5-propan-2-ylpyrazole-3-carboxamide;[1-(3-chlorophenyl)-5-propan-2-ylpyrazol-3-yl]-(4-methylpiperazin-1-yl)methanone;1,3-dimethyl-5-propan-2-ylpyrazole;1,4-dimethyl-5-propan-2-ylpyrazole;1,5-di(propan-2-yl)-3-(trifluoromethyl)pyrazole;1-(4-fluoro-3-methylphenyl)-N,N-dimethyl-5-propan-2-ylpyrazole-3-carboxamide;3-methyl-1,5-di(propan-2-yl)pyrazole;4-(3-methyl-5-propan-2-ylpyrazol-1-yl)pyridine;1-methyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole
CID 159723244
1-tert-butyl-3-methyl-5-propan-2-ylpyrazole;1-(4-chloro-3-methylphenyl)-N-(1-methylpiperidin-4-yl)-5-propan-2-ylpyrazole-3-carboxamide;3,4-dimethyl-1,5-di(propan-2-yl)pyrazole;1,3-dimethyl-5-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,4-dimethyl-5-propan-2-ylpyrazole;1,5-di(propan-2-yl)-3-(trifluoromethyl)pyrazole;1-(4-fluoro-3-methylphenyl)-N,N-dimethyl-5-propan-2-ylpyrazole-3-carboxamide;1-methyl-3,4-di(propan-2-yl)pyrazole;1-methyl-4,5-di(propan-2-yl)pyrazole;3-methyl-1,5-di(propan-2-yl)pyrazole;4-(3-methyl-5-propan-2-ylpyrazol-1-yl)pyridine;1-methyl-5-propan-2-yl-3-(trifluoromethyl)pyrazole;1,3,4-trimethyl-5-propan-2-ylpyrazole;1,3,5-tri(propan-2-yl)pyrazole
CID 159767299
4-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-5-carboxamide;3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline
CID 159933283
4-chloro-1-methyl-N-[4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]pyrazole-5-carboxamide;N-[(4-chloro-1-methylpyrazol-5-yl)methyl]-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline
CID 160366317
3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide;N-[4-[3-(difluoromethyl)-5-methylpyrazol-1-yl]-3-fluorophenyl]-2,6-difluorobenzamide;N-[4-[3-(difluoromethyl)-1-methylpyrazol-5-yl]-3-fluorophenyl]-2,6-difluoro-4-methylbenzamide;N-[4-[3-(difluoromethyl)-5-methylpyrazol-1-yl]-3-fluorophenyl]-2,6-difluoro-4-methylbenzamide;3-fluoro-N-[(5-methyl-2H-pyrrol-4-yl)methyl]-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]aniline
CID 160521822

Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-(1,1-difluoroethyl)-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-5-carboxamide;4-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide?
The IUPAC name of 4-chloro-3-(1,1-difluoroethyl)-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-5-carboxamide;4-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide (CID 159306088) is 4-chloro-3-(1,1-difluoroethyl)-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-5-carboxamide;4-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide.
What is the SMILES notation for 4-chloro-3-(1,1-difluoroethyl)-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-5-carboxamide;4-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide?
The canonical SMILES for 4-chloro-3-(1,1-difluoroethyl)-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-5-carboxamide;4-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide is Cn1cc(Cl)c(C(=O)Nc2ccc(-c3cc(C(F)(F)F)nn3C)c(F)c2)n1.Cn1ccc(Cl)c1C(=O)Nc1ccc(-c2cc(C(F)(F)F)nn2C)c(F)c1.Cn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)c2c(Cl)c(C(C)(F)F)nn2C)cc1F.
What is the InChIKey of 4-chloro-3-(1,1-difluoroethyl)-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-5-carboxamide;4-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide?
The InChIKey is LBXYNMITSXUKSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClF6N5O.C17H13ClF4N4O.C16H12ClF4N5O/c1-17(21,22)15-13(19)14(30(3)28-15)16(31)26-8-4-5-9(10(20)6-8)11-7-12(18(23,24)25)27-29(11)2;1-25-6-5-11(18)15(25)16(27)23-9-3-4-10(12(19)7-9)13-8-14(17(20,21)22)24-26(13)2;1-25-7-10(17)14(24-25)15(27)22-8-3-4-9(11(18)5-8)12-6-13(16(19,20)21)23-26(12)2/h4-7H,1-3H3,(H,26,31);3-8H,1-2H3,(H,23,27);3-7H,1-2H3,(H,22,27).
What are the key properties of 4-chloro-3-(1,1-difluoroethyl)-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-5-carboxamide;4-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide?
4-chloro-3-(1,1-difluoroethyl)-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-5-carboxamide;4-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide has a molecular weight of 1268.30 g/mol, XLogP of 13.37, 10 rotatable bonds, 3 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-(1,1-difluoroethyl)-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-5-carboxamide;4-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrazole-3-carboxamide;3-chloro-N-[3-fluoro-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]phenyl]-1-methylpyrrole-2-carboxamide is sourced from PubChem (CID 159306088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).