N-[1-(4-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[(1,5-dimethylpyrrol-2-yl)methyl]-4,6-dimethyl-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide

C90H87ClF3N11O6 — CID 159665508

IUPACN-[1-(4-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[(1,5-dimethylpyrrol-2-yl)methyl]-4,6-dimethyl-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide
SMILESCC(NC(=O)c1cc2ccccc2[nH]1)c1ccc(C(F)(F)F)cc1.CC(NC(=O)c1cc2ccccc2[nH]1)c1ccc(Cl)cc1.CC(NC(=O)c1cc2ccccc2[nH]1)c1ccccc1.COc1ccc(C(NC(=O)c2cc3ccccc3[nH]2)C2CC2)cc1.Cc1cc(C)c2cc(C(=O)NCc3ccc(C)n3C)[nH]c2c1
InChIInChI=1S/C20H20N2O2.C18H15F3N2O.C18H21N3O.C17H15ClN2O.C17H16N2O/c1-24-16-10-8-14(9-11-16)19(13-6-7-13)22-20(23)18-12-15-4-2-3-5-17(15)21-18;1-11(12-6-8-14(9-7-12)18(19,20)21)22-17(24)16-10-13-4-2-3-5-15(13)23-16;1-11-7-12(2)15-9-17(20-16(15)8-11)18(22)19-10-14-6-5-13(3)21(14)4;1-11(12-6-8-14(18)9-7-12)19-17(21)16-10-13-4-2-3-5-15(13)20-16;1-12(13-7-3-2-4-8-13)18-17(20)16-11-14-9-5-6-10-15(14)19-16/h2-5,8-13,19,21H,6-7H2,1H3,(H,22,23);2-11,23H,1H3,(H,22,24);5-9,20H,10H2,1-4H3,(H,19,22);2-11,20H,1H3,(H,19,21);2-12,19H,1H3,(H,18,20)
InChIKeyMTIUGNVUCSEBEM-UHFFFAOYSA-N
MW1511.20 g/mol
LogP20.07
Rot. Bonds17

About N-[1-(4-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[(1,5-dimethylpyrrol-2-yl)methyl]-4,6-dimethyl-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide

N-[1-(4-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[(1,5-dimethylpyrrol-2-yl)methyl]-4,6-dimethyl-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide (PubChem CID 159665508) has the molecular formula C90H87ClF3N11O6 and a molecular weight of 1511.20 g/mol. Its IUPAC name is N-[1-(4-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[(1,5-dimethylpyrrol-2-yl)methyl]-4,6-dimethyl-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[1-(4-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[(1,5-dimethylpyrrol-2-yl)methyl]-4,6-dimethyl-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide
PubChem CID159665508
Molecular FormulaC90H87ClF3N11O6
Molecular Weight1511.20 g/mol
Exact Mass1509.65
IUPAC NameN-[1-(4-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[(1,5-dimethylpyrrol-2-yl)methyl]-4,6-dimethyl-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide
SMILESCC(NC(=O)c1cc2ccccc2[nH]1)c1ccc(C(F)(F)F)cc1.CC(NC(=O)c1cc2ccccc2[nH]1)c1ccc(Cl)cc1.CC(NC(=O)c1cc2ccccc2[nH]1)c1ccccc1.COc1ccc(C(NC(=O)c2cc3ccccc3[nH]2)C2CC2)cc1.Cc1cc(C)c2cc(C(=O)NCc3ccc(C)n3C)[nH]c2c1
InChIInChI=1S/C20H20N2O2.C18H15F3N2O.C18H21N3O.C17H15ClN2O.C17H16N2O/c1-24-16-10-8-14(9-11-16)19(13-6-7-13)22-20(23)18-12-15-4-2-3-5-17(15)21-18;1-11(12-6-8-14(9-7-12)18(19,20)21)22-17(24)16-10-13-4-2-3-5-15(13)23-16;1-11-7-12(2)15-9-17(20-16(15)8-11)18(22)19-10-14-6-5-13(3)21(14)4;1-11(12-6-8-14(18)9-7-12)19-17(21)16-10-13-4-2-3-5-15(13)20-16;1-12(13-7-3-2-4-8-13)18-17(20)16-11-14-9-5-6-10-15(14)19-16/h2-5,8-13,19,21H,6-7H2,1H3,(H,22,23);2-11,23H,1H3,(H,22,24);5-9,20H,10H2,1-4H3,(H,19,22);2-11,20H,1H3,(H,19,21);2-12,19H,1H3,(H,18,20)
InChIKeyMTIUGNVUCSEBEM-UHFFFAOYSA-N
XLogP20.07
TPSA238.61 Ų
H-Bond Donors10
H-Bond Acceptors7
Rotatable Bonds17
Heavy Atoms111
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001511.20
LogP ≤ 520.07
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 107

Analyze N-[1-(4-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[(1,5-dimethylpyrrol-2-yl)methyl]-4,6-dimethyl-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide with MolForge

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Related Compounds

N-[(2S)-1-[(1S,4S)-5-[2-chloro-5-(trifluoromethyl)benzoyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-1H-indole-2-carboxamide;N-[(2S)-1-[(1S,4S)-5-(2-methoxy-4-methylbenzoyl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-3,3-dimethyl-1-oxobutan-2-yl]-1H-indole-2-carboxamide
CID 134247244
6-[6-[6-[6-[bis(4-methoxyphenyl)-phenylmethoxy]hexanoyl]-3a,7,8,8b-tetrahydro-3H-pyrrolo[3,2-e]indole-2-carbonyl]-7,8-dihydro-3H-pyrrolo[3,2-e]indole-2-carbonyl]-N-methyl-N-[6-[methyl-(2,2,2-trifluoroacetyl)amino]hexyl]-7,8-dihydro-3H-pyrrolo[3,2-e]indole-2-carboxamide
CID 138654516
5-chloro-4-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;4-methyl-N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethoxy)-1H-indole-2-carboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethyl)-1H-indole-2-carboxamide
CID 157282098
5-chloro-N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;5-methyl-N-[(4-methylphenyl)methyl]-1H-indole-2-carboxamide;5-methyl-N-(1-phenylethyl)-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide
CID 157497105
N-[(1R)-1-[2,5-bis(trifluoromethyl)phenyl]ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(1S)-1-[2,5-bis(trifluoromethyl)phenyl]ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;hexakis(carbon dioxide);N-[(1S)-1-(3-chlorophenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(1R)-1-(2,3-dichlorophenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;2,3-dimethyl-N-[(1S)-1-(3-methylphenyl)ethyl]-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(1S)-1-(2-methoxyphenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide
CID 158194949
CID 158535226
CID 158535226
3-[2-(4-chloro-3-fluorophenyl)-1H-indol-3-yl]-N-[(3S,4R)-4-hydroxy-2-oxopyrrolidin-3-yl]propanamide;3-[2-(2-fluoro-4-methylphenyl)-1H-indol-3-yl]-N-[(3S,4R)-4-hydroxy-2-oxopyrrolidin-3-yl]propanamide;3-[2-(4-fluoro-2-methylphenyl)-1H-indol-3-yl]-N-[(3S,4R)-4-hydroxy-2-oxopyrrolidin-3-yl]propanamide;N-[(3S,4R)-4-hydroxy-2-oxopyrrolidin-3-yl]-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]propanamide;N-[(3S,4R)-4-hydroxy-2-oxopyrrolidin-3-yl]-3-[2-[4-(trifluoromethoxy)phenyl]-1H-indol-3-yl]propanamide
CID 158989010
N-[(1R)-1-[2,5-bis(trifluoromethyl)phenyl]ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;pentakis(carbon dioxide);N-[(1S)-1-(3-chlorophenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;2,3-dimethyl-N-[(1S)-1-(3-methylphenyl)ethyl]-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(1S)-1-(3-fluoro-2-methoxyphenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(1S)-1-(2-methoxyphenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide
CID 159586072
hexakis(carbon dioxide);N-[(1R)-1-[2-chloro-5-(trifluoromethyl)phenyl]ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(1S)-1-[3-(cyclopropylmethyl)phenyl]ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(1R)-1-(2-fluoro-4-methylphenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(1R)-1-[2-fluoro-6-(trifluoromethyl)phenyl]ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(1S)-1-(6-methoxy-3-pyridinyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide
CID 159715849
N-[1-(4-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;4,5-dichloro-N-(1-pyridin-3-ylethyl)-1H-indole-2-carboxamide;N-[(1,5-dimethylpyrrol-2-yl)methyl]-4,6-dimethyl-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide
CID 159907066
tris(carbon dioxide);N-[(1S)-1-(4-chloro-2-methylphenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;2-[4-[[5-[[(1S)-1-(4-ethylphenyl)ethyl]carbamoyl]-2,3-dimethylindol-1-yl]methyl]phenyl]benzoic acid;N-[(1S)-1-(3-fluoro-4-methylphenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(1S)-1-[4-fluoro-2-(trifluoromethyl)phenyl]ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;2-[4-[[5-[[(1R)-1-(2-methoxy-4-methylphenyl)ethyl]carbamoyl]-2,3-dimethylindol-1-yl]methyl]phenyl]benzoic acid;2-[4-[[5-[[(1S)-1-(2-methoxy-4-methylphenyl)ethyl]carbamoyl]-2,3-dimethylindol-1-yl]methyl]phenyl]benzoic acid
CID 160141104
6-tert-butyl-5-(4-chloro-2-methoxyphenyl)-1H-indole;6-tert-butyl-5-(2-ethoxyphenyl)-1H-indole;4-(6-tert-butyl-1H-indol-5-yl)-N-[2-(dimethylamino)ethyl]benzamide;6-tert-butyl-5-(2-methoxyphenyl)-1H-indole;6-tert-butyl-N-(2-methylpropyl)-1H-indole-5-carboxamide;6-tert-butyl-5-(trifluoromethyl)-1H-indole;ethyl 6-tert-butyl-1H-indole-5-carboxylate
CID 160272881

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[(1,5-dimethylpyrrol-2-yl)methyl]-4,6-dimethyl-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide?
The IUPAC name of N-[1-(4-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[(1,5-dimethylpyrrol-2-yl)methyl]-4,6-dimethyl-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide (CID 159665508) is N-[1-(4-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[(1,5-dimethylpyrrol-2-yl)methyl]-4,6-dimethyl-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide.
What is the SMILES notation for N-[1-(4-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[(1,5-dimethylpyrrol-2-yl)methyl]-4,6-dimethyl-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide?
The canonical SMILES for N-[1-(4-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[(1,5-dimethylpyrrol-2-yl)methyl]-4,6-dimethyl-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide is CC(NC(=O)c1cc2ccccc2[nH]1)c1ccc(C(F)(F)F)cc1.CC(NC(=O)c1cc2ccccc2[nH]1)c1ccc(Cl)cc1.CC(NC(=O)c1cc2ccccc2[nH]1)c1ccccc1.COc1ccc(C(NC(=O)c2cc3ccccc3[nH]2)C2CC2)cc1.Cc1cc(C)c2cc(C(=O)NCc3ccc(C)n3C)[nH]c2c1.
What is the InChIKey of N-[1-(4-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[(1,5-dimethylpyrrol-2-yl)methyl]-4,6-dimethyl-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide?
The InChIKey is MTIUGNVUCSEBEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2.C18H15F3N2O.C18H21N3O.C17H15ClN2O.C17H16N2O/c1-24-16-10-8-14(9-11-16)19(13-6-7-13)22-20(23)18-12-15-4-2-3-5-17(15)21-18;1-11(12-6-8-14(9-7-12)18(19,20)21)22-17(24)16-10-13-4-2-3-5-15(13)23-16;1-11-7-12(2)15-9-17(20-16(15)8-11)18(22)19-10-14-6-5-13(3)21(14)4;1-11(12-6-8-14(18)9-7-12)19-17(21)16-10-13-4-2-3-5-15(13)20-16;1-12(13-7-3-2-4-8-13)18-17(20)16-11-14-9-5-6-10-15(14)19-16/h2-5,8-13,19,21H,6-7H2,1H3,(H,22,23);2-11,23H,1H3,(H,22,24);5-9,20H,10H2,1-4H3,(H,19,22);2-11,20H,1H3,(H,19,21);2-12,19H,1H3,(H,18,20).
What are the key properties of N-[1-(4-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[(1,5-dimethylpyrrol-2-yl)methyl]-4,6-dimethyl-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide?
N-[1-(4-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[(1,5-dimethylpyrrol-2-yl)methyl]-4,6-dimethyl-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide has a molecular weight of 1511.20 g/mol, XLogP of 20.07, 17 rotatable bonds, 10 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[(1,5-dimethylpyrrol-2-yl)methyl]-4,6-dimethyl-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide is sourced from PubChem (CID 159665508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).