4-[4-[2-chloro-6-fluoro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[4-[2-chloro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[1-ethyl-4-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]pyrazol-3-yl]pyridine-2-carboxamide

C75H60Cl2F10N18O6 — CID 159361425

IUPAC4-[4-[2-chloro-6-fluoro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[4-[2-chloro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[1-ethyl-4-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]pyrazol-3-yl]pyridine-2-carboxamide
SMILESCCn1cc(-c2c(F)ccc(NC(=O)Nc3ccc(C(F)(F)F)cc3)c2Cl)c(-c2ccnc(C(N)=O)c2)n1.CCn1cc(-c2cccc(NC(=O)Nc3ccc(C(F)(F)F)cc3)c2)c(-c2ccnc(C(N)=O)c2)n1.CCn1cc(-c2cccc(NC(=O)Nc3ccc(C(F)(F)F)cc3)c2Cl)c(-c2ccnc(C(N)=O)c2)n1
InChIInChI=1S/C25H19ClF4N6O2.C25H20ClF3N6O2.C25H21F3N6O2/c1-2-36-12-16(22(35-36)13-9-10-32-19(11-13)23(31)37)20-17(27)7-8-18(21(20)26)34-24(38)33-15-5-3-14(4-6-15)25(28,29)30;1-2-35-13-18(22(34-35)14-10-11-31-20(12-14)23(30)36)17-4-3-5-19(21(17)26)33-24(37)32-16-8-6-15(7-9-16)25(27,28)29;1-2-34-14-20(22(33-34)16-10-11-30-21(13-16)23(29)35)15-4-3-5-19(12-15)32-24(36)31-18-8-6-17(7-9-18)25(26,27)28/h3-12H,2H2,1H3,(H2,31,37)(H2,33,34,38);3-13H,2H2,1H3,(H2,30,36)(H2,32,33,37);3-14H,2H2,1H3,(H2,29,35)(H2,31,32,36)
InChIKeyLIOZLLFZWHMXKE-UHFFFAOYSA-N
MW1570.31 g/mol
LogP17.63
Rot. Bonds18

About 4-[4-[2-chloro-6-fluoro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[4-[2-chloro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[1-ethyl-4-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]pyrazol-3-yl]pyridine-2-carboxamide

4-[4-[2-chloro-6-fluoro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[4-[2-chloro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[1-ethyl-4-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]pyrazol-3-yl]pyridine-2-carboxamide (PubChem CID 159361425) has the molecular formula C75H60Cl2F10N18O6 and a molecular weight of 1570.31 g/mol. Its IUPAC name is 4-[4-[2-chloro-6-fluoro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[4-[2-chloro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[1-ethyl-4-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]pyrazol-3-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[4-[2-chloro-6-fluoro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[4-[2-chloro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[1-ethyl-4-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]pyrazol-3-yl]pyridine-2-carboxamide
PubChem CID159361425
Molecular FormulaC75H60Cl2F10N18O6
Molecular Weight1570.31 g/mol
Exact Mass1568.42
IUPAC Name4-[4-[2-chloro-6-fluoro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[4-[2-chloro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[1-ethyl-4-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]pyrazol-3-yl]pyridine-2-carboxamide
SMILESCCn1cc(-c2c(F)ccc(NC(=O)Nc3ccc(C(F)(F)F)cc3)c2Cl)c(-c2ccnc(C(N)=O)c2)n1.CCn1cc(-c2cccc(NC(=O)Nc3ccc(C(F)(F)F)cc3)c2)c(-c2ccnc(C(N)=O)c2)n1.CCn1cc(-c2cccc(NC(=O)Nc3ccc(C(F)(F)F)cc3)c2Cl)c(-c2ccnc(C(N)=O)c2)n1
InChIInChI=1S/C25H19ClF4N6O2.C25H20ClF3N6O2.C25H21F3N6O2/c1-2-36-12-16(22(35-36)13-9-10-32-19(11-13)23(31)37)20-17(27)7-8-18(21(20)26)34-24(38)33-15-5-3-14(4-6-15)25(28,29)30;1-2-35-13-18(22(34-35)14-10-11-31-20(12-14)23(30)36)17-4-3-5-19(21(17)26)33-24(37)32-16-8-6-15(7-9-16)25(27,28)29;1-2-34-14-20(22(33-34)16-10-11-30-21(13-16)23(29)35)15-4-3-5-19(12-15)32-24(36)31-18-8-6-17(7-9-18)25(26,27)28/h3-12H,2H2,1H3,(H2,31,37)(H2,33,34,38);3-13H,2H2,1H3,(H2,30,36)(H2,32,33,37);3-14H,2H2,1H3,(H2,29,35)(H2,31,32,36)
InChIKeyLIOZLLFZWHMXKE-UHFFFAOYSA-N
XLogP17.63
TPSA344.79 Ų
H-Bond Donors9
H-Bond Acceptors15
Rotatable Bonds18
Heavy Atoms111
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001570.31
LogP ≤ 517.63
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1015

Analyze 4-[4-[2-chloro-6-fluoro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[4-[2-chloro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[1-ethyl-4-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]pyrazol-3-yl]pyridine-2-carboxamide with MolForge

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Related Compounds

1-(2-((2S,4R)-2-(3-(3-chloropyridin-2-yl)-2-fluorophenylcarbamoyl)-4-fluoropyrrolidin-1-yl)-2-oxoethyl)-5-(3,3-difluoropiperidine-1-carboxamido)-1H-indazole-3-carboxamide
CID 118322373
4-[4-[2-Chloro-5-fluoro-3-[(4-fluorophenyl)carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide
CID 68351491
4-[4-[4-Chloro-3-[(4-fluorophenyl)carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide
CID 68351495
4-[4-[2-Chloro-3-[(4-fluorophenyl)carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide
CID 68351497
4-[4-[5-Chloro-2-fluoro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide
CID 68351498
4-[4-[2-Chloro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide
CID 68351504
4-[4-[2-Chloro-5-fluoro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide
CID 68351505
4-[4-[4-Chloro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide
CID 68351514
4-[4-[2-Chloro-5-fluoro-3-[(4-methylphenyl)carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide
CID 68351626
4-[4-[2-Chloro-3-[(4-chlorophenyl)carbamoylamino]-5-fluorophenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide
CID 68351825
4-[4-[2-Chloro-6-fluoro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide
CID 90326726
1-[2-[2-[[3-(3-Chloro-2-pyridinyl)-2-fluorophenyl]carbamoyl]-4-fluoropyrrolidin-1-yl]-2-oxoethyl]-5-[(3,3-difluoropiperidine-1-carbonyl)amino]indazole-3-carboxamide
CID 123987284

Frequently Asked Questions

What is the IUPAC name of 4-[4-[2-chloro-6-fluoro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[4-[2-chloro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[1-ethyl-4-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]pyrazol-3-yl]pyridine-2-carboxamide?
The IUPAC name of 4-[4-[2-chloro-6-fluoro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[4-[2-chloro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[1-ethyl-4-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]pyrazol-3-yl]pyridine-2-carboxamide (CID 159361425) is 4-[4-[2-chloro-6-fluoro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[4-[2-chloro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[1-ethyl-4-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]pyrazol-3-yl]pyridine-2-carboxamide.
What is the SMILES notation for 4-[4-[2-chloro-6-fluoro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[4-[2-chloro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[1-ethyl-4-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]pyrazol-3-yl]pyridine-2-carboxamide?
The canonical SMILES for 4-[4-[2-chloro-6-fluoro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[4-[2-chloro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[1-ethyl-4-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]pyrazol-3-yl]pyridine-2-carboxamide is CCn1cc(-c2c(F)ccc(NC(=O)Nc3ccc(C(F)(F)F)cc3)c2Cl)c(-c2ccnc(C(N)=O)c2)n1.CCn1cc(-c2cccc(NC(=O)Nc3ccc(C(F)(F)F)cc3)c2)c(-c2ccnc(C(N)=O)c2)n1.CCn1cc(-c2cccc(NC(=O)Nc3ccc(C(F)(F)F)cc3)c2Cl)c(-c2ccnc(C(N)=O)c2)n1.
What is the InChIKey of 4-[4-[2-chloro-6-fluoro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[4-[2-chloro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[1-ethyl-4-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]pyrazol-3-yl]pyridine-2-carboxamide?
The InChIKey is LIOZLLFZWHMXKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19ClF4N6O2.C25H20ClF3N6O2.C25H21F3N6O2/c1-2-36-12-16(22(35-36)13-9-10-32-19(11-13)23(31)37)20-17(27)7-8-18(21(20)26)34-24(38)33-15-5-3-14(4-6-15)25(28,29)30;1-2-35-13-18(22(34-35)14-10-11-31-20(12-14)23(30)36)17-4-3-5-19(21(17)26)33-24(37)32-16-8-6-15(7-9-16)25(27,28)29;1-2-34-14-20(22(33-34)16-10-11-30-21(13-16)23(29)35)15-4-3-5-19(12-15)32-24(36)31-18-8-6-17(7-9-18)25(26,27)28/h3-12H,2H2,1H3,(H2,31,37)(H2,33,34,38);3-13H,2H2,1H3,(H2,30,36)(H2,32,33,37);3-14H,2H2,1H3,(H2,29,35)(H2,31,32,36).
What are the key properties of 4-[4-[2-chloro-6-fluoro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[4-[2-chloro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[1-ethyl-4-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]pyrazol-3-yl]pyridine-2-carboxamide?
4-[4-[2-chloro-6-fluoro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[4-[2-chloro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[1-ethyl-4-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]pyrazol-3-yl]pyridine-2-carboxamide has a molecular weight of 1570.31 g/mol, XLogP of 17.63, 18 rotatable bonds, 9 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[2-chloro-6-fluoro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[4-[2-chloro-3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1-ethylpyrazol-3-yl]pyridine-2-carboxamide;4-[1-ethyl-4-[3-[[4-(trifluoromethyl)phenyl]carbamoylamino]phenyl]pyrazol-3-yl]pyridine-2-carboxamide is sourced from PubChem (CID 159361425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).