2,3-difluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]furan-3-carboxamide;5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;N-[5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide

C78H52F18N12O5 — CID 161474720

IUPAC2,3-difluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]furan-3-carboxamide;5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;N-[5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide
SMILESNc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc12.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc12)c1ccoc1.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12)c1cccc(F)c1F.O=C(Nc1nn(Cc2ccc(F)cc2)c2ccccc12)c1ccoc1
InChIInChI=1S/C22H14F5N3O.C21H13F6N3O2.C19H14FN3O2.C16H11F6N3/c23-17-6-3-5-16(19(17)24)21(31)28-20-15-4-1-2-7-18(15)30(29-20)12-13-8-10-14(11-9-13)22(25,26)27;22-20(23,24)14-3-1-12(2-4-14)10-30-17-6-5-15(21(25,26)27)9-16(17)18(29-30)28-19(31)13-7-8-32-11-13;20-15-7-5-13(6-8-15)11-23-17-4-2-1-3-16(17)18(22-23)21-19(24)14-9-10-25-12-14;17-15(18,19)10-3-1-9(2-4-10)8-25-13-6-5-11(16(20,21)22)7-12(13)14(23)24-25/h1-11H,12H2,(H,28,29,31);1-9,11H,10H2,(H,28,29,31);1-10,12H,11H2,(H,21,22,24);1-7H,8H2,(H2,23,24)
InChIKeyWDOFWXSFAAFKKW-UHFFFAOYSA-N
MW1579.32 g/mol
LogP20.37
Rot. Bonds14

About 2,3-difluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]furan-3-carboxamide;5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;N-[5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide

2,3-difluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]furan-3-carboxamide;5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;N-[5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide (PubChem CID 161474720) has the molecular formula C78H52F18N12O5 and a molecular weight of 1579.32 g/mol. Its IUPAC name is 2,3-difluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]furan-3-carboxamide;5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;N-[5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide.

Molecular Properties

Compound Name2,3-difluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]furan-3-carboxamide;5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;N-[5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide
PubChem CID161474720
Molecular FormulaC78H52F18N12O5
Molecular Weight1579.32 g/mol
Exact Mass1578.39
IUPAC Name2,3-difluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]furan-3-carboxamide;5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;N-[5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide
SMILESNc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc12.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc12)c1ccoc1.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12)c1cccc(F)c1F.O=C(Nc1nn(Cc2ccc(F)cc2)c2ccccc12)c1ccoc1
InChIInChI=1S/C22H14F5N3O.C21H13F6N3O2.C19H14FN3O2.C16H11F6N3/c23-17-6-3-5-16(19(17)24)21(31)28-20-15-4-1-2-7-18(15)30(29-20)12-13-8-10-14(11-9-13)22(25,26)27;22-20(23,24)14-3-1-12(2-4-14)10-30-17-6-5-15(21(25,26)27)9-16(17)18(29-30)28-19(31)13-7-8-32-11-13;20-15-7-5-13(6-8-15)11-23-17-4-2-1-3-16(17)18(22-23)21-19(24)14-9-10-25-12-14;17-15(18,19)10-3-1-9(2-4-10)8-25-13-6-5-11(16(20,21)22)7-12(13)14(23)24-25/h1-11H,12H2,(H,28,29,31);1-9,11H,10H2,(H,28,29,31);1-10,12H,11H2,(H,21,22,24);1-7H,8H2,(H2,23,24)
InChIKeyWDOFWXSFAAFKKW-UHFFFAOYSA-N
XLogP20.37
TPSA210.88 Ų
H-Bond Donors4
H-Bond Acceptors14
Rotatable Bonds14
Heavy Atoms113
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001579.32
LogP ≤ 520.37
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1014

Analyze 2,3-difluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]furan-3-carboxamide;5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;N-[5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide with MolForge

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Related Compounds

2-Methyl-N-(1-((4-(trifluoromethyl)phenyl)methyl)-1H-indazol-3-yl)-3-furancarboxamide
CID 91844684
N-[1-[[3-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide
CID 118326026
N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]furan-3-carboxamide
CID 118335370
N-[6-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide
CID 118335377
2-methyl-N-[6-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide
CID 118335379
N-[1-[(4-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide
CID 118335415
N-[5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide
CID 118335482
2-methyl-N-[5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide
CID 118335483
N-[7-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide
CID 118453548
2-methyl-N-[7-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide
CID 118453557
4-methyl-N-[5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide
CID 118463341
N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide
CID 118463416

Frequently Asked Questions

What is the IUPAC name of 2,3-difluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]furan-3-carboxamide;5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;N-[5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide?
The IUPAC name of 2,3-difluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]furan-3-carboxamide;5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;N-[5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide (CID 161474720) is 2,3-difluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]furan-3-carboxamide;5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;N-[5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide.
What is the SMILES notation for 2,3-difluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]furan-3-carboxamide;5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;N-[5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide?
The canonical SMILES for 2,3-difluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]furan-3-carboxamide;5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;N-[5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide is Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc12.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc12)c1ccoc1.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12)c1cccc(F)c1F.O=C(Nc1nn(Cc2ccc(F)cc2)c2ccccc12)c1ccoc1.
What is the InChIKey of 2,3-difluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]furan-3-carboxamide;5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;N-[5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide?
The InChIKey is WDOFWXSFAAFKKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14F5N3O.C21H13F6N3O2.C19H14FN3O2.C16H11F6N3/c23-17-6-3-5-16(19(17)24)21(31)28-20-15-4-1-2-7-18(15)30(29-20)12-13-8-10-14(11-9-13)22(25,26)27;22-20(23,24)14-3-1-12(2-4-14)10-30-17-6-5-15(21(25,26)27)9-16(17)18(29-30)28-19(31)13-7-8-32-11-13;20-15-7-5-13(6-8-15)11-23-17-4-2-1-3-16(17)18(22-23)21-19(24)14-9-10-25-12-14;17-15(18,19)10-3-1-9(2-4-10)8-25-13-6-5-11(16(20,21)22)7-12(13)14(23)24-25/h1-11H,12H2,(H,28,29,31);1-9,11H,10H2,(H,28,29,31);1-10,12H,11H2,(H,21,22,24);1-7H,8H2,(H2,23,24).
What are the key properties of 2,3-difluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]furan-3-carboxamide;5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;N-[5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide?
2,3-difluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]furan-3-carboxamide;5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;N-[5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide has a molecular weight of 1579.32 g/mol, XLogP of 20.37, 14 rotatable bonds, 4 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-difluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]furan-3-carboxamide;5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;N-[5-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide is sourced from PubChem (CID 161474720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).