2-(3-fluorophenyl)-1H-indole-4-carboxamide;2-(3-phenylphenyl)-1H-indole-4-carboxamide;2-(3-propan-2-ylphenyl)-1H-indole-4-carboxamide;2-[3-(trifluoromethyl)phenyl]-1H-indole-4-carboxamide

C70H56F4N8O4 — CID 162263529

IUPAC2-(3-fluorophenyl)-1H-indole-4-carboxamide;2-(3-phenylphenyl)-1H-indole-4-carboxamide;2-(3-propan-2-ylphenyl)-1H-indole-4-carboxamide;2-[3-(trifluoromethyl)phenyl]-1H-indole-4-carboxamide
SMILESCC(C)c1cccc(-c2cc3c(C(N)=O)cccc3[nH]2)c1.NC(=O)c1cccc2[nH]c(-c3cccc(-c4ccccc4)c3)cc12.NC(=O)c1cccc2[nH]c(-c3cccc(C(F)(F)F)c3)cc12.NC(=O)c1cccc2[nH]c(-c3cccc(F)c3)cc12
InChIInChI=1S/C21H16N2O.C18H18N2O.C16H11F3N2O.C15H11FN2O/c22-21(24)17-10-5-11-19-18(17)13-20(23-19)16-9-4-8-15(12-16)14-6-2-1-3-7-14;1-11(2)12-5-3-6-13(9-12)17-10-15-14(18(19)21)7-4-8-16(15)20-17;17-16(18,19)10-4-1-3-9(7-10)14-8-12-11(15(20)22)5-2-6-13(12)21-14;16-10-4-1-3-9(7-10)14-8-12-11(15(17)19)5-2-6-13(12)18-14/h1-13,23H,(H2,22,24);3-11,20H,1-2H3,(H2,19,21);1-8,21H,(H2,20,22);1-8,18H,(H2,17,19)
InChIKeyZZOVWUIZYVTBMF-UHFFFAOYSA-N
MW1149.26 g/mol
LogP15.68
Rot. Bonds10

About 2-(3-fluorophenyl)-1H-indole-4-carboxamide;2-(3-phenylphenyl)-1H-indole-4-carboxamide;2-(3-propan-2-ylphenyl)-1H-indole-4-carboxamide;2-[3-(trifluoromethyl)phenyl]-1H-indole-4-carboxamide

2-(3-fluorophenyl)-1H-indole-4-carboxamide;2-(3-phenylphenyl)-1H-indole-4-carboxamide;2-(3-propan-2-ylphenyl)-1H-indole-4-carboxamide;2-[3-(trifluoromethyl)phenyl]-1H-indole-4-carboxamide (PubChem CID 162263529) has the molecular formula C70H56F4N8O4 and a molecular weight of 1149.26 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-1H-indole-4-carboxamide;2-(3-phenylphenyl)-1H-indole-4-carboxamide;2-(3-propan-2-ylphenyl)-1H-indole-4-carboxamide;2-[3-(trifluoromethyl)phenyl]-1H-indole-4-carboxamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-1H-indole-4-carboxamide;2-(3-phenylphenyl)-1H-indole-4-carboxamide;2-(3-propan-2-ylphenyl)-1H-indole-4-carboxamide;2-[3-(trifluoromethyl)phenyl]-1H-indole-4-carboxamide
PubChem CID162263529
Molecular FormulaC70H56F4N8O4
Molecular Weight1149.26 g/mol
Exact Mass1148.44
IUPAC Name2-(3-fluorophenyl)-1H-indole-4-carboxamide;2-(3-phenylphenyl)-1H-indole-4-carboxamide;2-(3-propan-2-ylphenyl)-1H-indole-4-carboxamide;2-[3-(trifluoromethyl)phenyl]-1H-indole-4-carboxamide
SMILESCC(C)c1cccc(-c2cc3c(C(N)=O)cccc3[nH]2)c1.NC(=O)c1cccc2[nH]c(-c3cccc(-c4ccccc4)c3)cc12.NC(=O)c1cccc2[nH]c(-c3cccc(C(F)(F)F)c3)cc12.NC(=O)c1cccc2[nH]c(-c3cccc(F)c3)cc12
InChIInChI=1S/C21H16N2O.C18H18N2O.C16H11F3N2O.C15H11FN2O/c22-21(24)17-10-5-11-19-18(17)13-20(23-19)16-9-4-8-15(12-16)14-6-2-1-3-7-14;1-11(2)12-5-3-6-13(9-12)17-10-15-14(18(19)21)7-4-8-16(15)20-17;17-16(18,19)10-4-1-3-9(7-10)14-8-12-11(15(20)22)5-2-6-13(12)21-14;16-10-4-1-3-9(7-10)14-8-12-11(15(17)19)5-2-6-13(12)18-14/h1-13,23H,(H2,22,24);3-11,20H,1-2H3,(H2,19,21);1-8,21H,(H2,20,22);1-8,18H,(H2,17,19)
InChIKeyZZOVWUIZYVTBMF-UHFFFAOYSA-N
XLogP15.68
TPSA235.52 Ų
H-Bond Donors8
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms86
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001149.26
LogP ≤ 515.68
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 104

Analyze 2-(3-fluorophenyl)-1H-indole-4-carboxamide;2-(3-phenylphenyl)-1H-indole-4-carboxamide;2-(3-propan-2-ylphenyl)-1H-indole-4-carboxamide;2-[3-(trifluoromethyl)phenyl]-1H-indole-4-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

2-[2-[2-[3-[2-(1,3-dioxoisoindol-2-yl)ethyl]-1H-indol-2-yl]-1H-indol-3-yl]ethyl]isoindole-1,3-dione
CID 45280995
9-Benzoyl-2-[4-[4-(9-benzoyl-1,3-dioxo-3a,4,10,10a-tetrahydropyrrolo[3,4-b]carbazol-2-yl)anilino]phenyl]-3a,4,10,10a-tetrahydropyrrolo[3,4-b]carbazole-1,3-dione
CID 399652
1-methyl-3-[2-[5-[3-[1-methyl-2,5-dioxo-4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyrrol-3-yl]-1H-indol-2-yl]pentyl]-1H-indol-3-yl]-4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyrrole-2,5-dione
CID 10653513
3,4-difluoro-N-[2-(2-methyl-1H-indol-3-yl)ethyl]benzamide;N-[2-(2-methyl-1H-indol-3-yl)ethyl]-4-(trifluoromethyl)benzamide
CID 68571648
4-[3-(4-fluoroanilino)-2-methylphenyl]-9H-carbazole-1,7-dicarboxamide
CID 68787311
1-[5-(3-benzylpyrrolidin-3-yl)-1H-indol-2-yl]-2,2,2-trifluoroethanone;1-[5-(1,3-dibenzylpyrrolidin-3-yl)-1H-indol-2-yl]-2,2,2-trifluoroethanone
CID 87450934
3-[3-fluoro-4-[[2-fluoro-5-(trifluoromethyl)phenyl]carbamoylamino]phenyl]-1H-indole-2-carboxamide;3-[4-[[2-fluoro-5-(trifluoromethyl)phenyl]carbamoylamino]-3-methylphenyl]-1H-indole-2-carboxamide
CID 87802060
(2R)-6-amino-N-[4-[bis[4-[[(2R)-6-amino-2-[[2-[2-methyl-5-(trifluoromethyl)-1H-indol-3-yl]acetyl]amino]hexanoyl]amino]phenyl]methyl]phenyl]-2-[[2-[2-methyl-5-(trifluoromethyl)-1H-indol-3-yl]acetyl]amino]hexanamide;hydrochloride
CID 87970924
(2S)-2,6-diamino-N-[4-[bis[4-[[(2S)-2,6-diamino-2-[2-[2-methyl-5-(trifluoromethyl)-1H-indol-3-yl]acetyl]hexanoyl]amino]phenyl]methyl]phenyl]-2-[2-[2-methyl-5-(trifluoromethyl)-1H-indol-3-yl]acetyl]hexanamide;hydrochloride
CID 87970926
CID 89411485
CID 89411485
[1-(2-ethylhexyl)-5-(2,4,6-trimethylbenzoyl)-11H-benzo[a]carbazol-8-yl]-(2-fluorophenyl)methanone
CID 89700810
(2S)-6-amino-N-[4-[bis[4-[[(2S)-6-amino-2-[[2-[2-methyl-5-(trifluoromethyl)-1H-indol-3-yl]acetyl]amino]hexanoyl]amino]phenyl]methyl]phenyl]-2-[[2-[2-methyl-5-(trifluoromethyl)-1H-indol-3-yl]acetyl]amino]hexanamide
CID 90848934

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-1H-indole-4-carboxamide;2-(3-phenylphenyl)-1H-indole-4-carboxamide;2-(3-propan-2-ylphenyl)-1H-indole-4-carboxamide;2-[3-(trifluoromethyl)phenyl]-1H-indole-4-carboxamide?
The IUPAC name of 2-(3-fluorophenyl)-1H-indole-4-carboxamide;2-(3-phenylphenyl)-1H-indole-4-carboxamide;2-(3-propan-2-ylphenyl)-1H-indole-4-carboxamide;2-[3-(trifluoromethyl)phenyl]-1H-indole-4-carboxamide (CID 162263529) is 2-(3-fluorophenyl)-1H-indole-4-carboxamide;2-(3-phenylphenyl)-1H-indole-4-carboxamide;2-(3-propan-2-ylphenyl)-1H-indole-4-carboxamide;2-[3-(trifluoromethyl)phenyl]-1H-indole-4-carboxamide.
What is the SMILES notation for 2-(3-fluorophenyl)-1H-indole-4-carboxamide;2-(3-phenylphenyl)-1H-indole-4-carboxamide;2-(3-propan-2-ylphenyl)-1H-indole-4-carboxamide;2-[3-(trifluoromethyl)phenyl]-1H-indole-4-carboxamide?
The canonical SMILES for 2-(3-fluorophenyl)-1H-indole-4-carboxamide;2-(3-phenylphenyl)-1H-indole-4-carboxamide;2-(3-propan-2-ylphenyl)-1H-indole-4-carboxamide;2-[3-(trifluoromethyl)phenyl]-1H-indole-4-carboxamide is CC(C)c1cccc(-c2cc3c(C(N)=O)cccc3[nH]2)c1.NC(=O)c1cccc2[nH]c(-c3cccc(-c4ccccc4)c3)cc12.NC(=O)c1cccc2[nH]c(-c3cccc(C(F)(F)F)c3)cc12.NC(=O)c1cccc2[nH]c(-c3cccc(F)c3)cc12.
What is the InChIKey of 2-(3-fluorophenyl)-1H-indole-4-carboxamide;2-(3-phenylphenyl)-1H-indole-4-carboxamide;2-(3-propan-2-ylphenyl)-1H-indole-4-carboxamide;2-[3-(trifluoromethyl)phenyl]-1H-indole-4-carboxamide?
The InChIKey is ZZOVWUIZYVTBMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N2O.C18H18N2O.C16H11F3N2O.C15H11FN2O/c22-21(24)17-10-5-11-19-18(17)13-20(23-19)16-9-4-8-15(12-16)14-6-2-1-3-7-14;1-11(2)12-5-3-6-13(9-12)17-10-15-14(18(19)21)7-4-8-16(15)20-17;17-16(18,19)10-4-1-3-9(7-10)14-8-12-11(15(20)22)5-2-6-13(12)21-14;16-10-4-1-3-9(7-10)14-8-12-11(15(17)19)5-2-6-13(12)18-14/h1-13,23H,(H2,22,24);3-11,20H,1-2H3,(H2,19,21);1-8,21H,(H2,20,22);1-8,18H,(H2,17,19).
What are the key properties of 2-(3-fluorophenyl)-1H-indole-4-carboxamide;2-(3-phenylphenyl)-1H-indole-4-carboxamide;2-(3-propan-2-ylphenyl)-1H-indole-4-carboxamide;2-[3-(trifluoromethyl)phenyl]-1H-indole-4-carboxamide?
2-(3-fluorophenyl)-1H-indole-4-carboxamide;2-(3-phenylphenyl)-1H-indole-4-carboxamide;2-(3-propan-2-ylphenyl)-1H-indole-4-carboxamide;2-[3-(trifluoromethyl)phenyl]-1H-indole-4-carboxamide has a molecular weight of 1149.26 g/mol, XLogP of 15.68, 10 rotatable bonds, 8 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-1H-indole-4-carboxamide;2-(3-phenylphenyl)-1H-indole-4-carboxamide;2-(3-propan-2-ylphenyl)-1H-indole-4-carboxamide;2-[3-(trifluoromethyl)phenyl]-1H-indole-4-carboxamide is sourced from PubChem (CID 162263529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).