N-[1-(3-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl(phenyl)methyl]-4-fluoro-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide;N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide

C84H77ClF2N10O6S — CID 159988728

IUPACN-[1-(3-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl(phenyl)methyl]-4-fluoro-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide;N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide
SMILESCC(NC(=O)c1cc2ccccc2[nH]1)c1cccc(Cl)c1.Cc1ccc(C(C)NC(=O)c2cc3ccccc3[nH]2)o1.Cc1ccc2[nH]c(C(=O)NC(C)c3cccc(F)c3)cc2c1.O=C(NC(c1ccccc1)C1CC1)c1cc2c(F)cccc2[nH]1.O=C(NCc1cccs1)c1cc2ccccc2[nH]1
InChIInChI=1S/C19H17FN2O.C18H17FN2O.C17H15ClN2O.C16H16N2O2.C14H12N2OS/c20-15-7-4-8-16-14(15)11-17(21-16)19(23)22-18(13-9-10-13)12-5-2-1-3-6-12;1-11-6-7-16-14(8-11)10-17(21-16)18(22)20-12(2)13-4-3-5-15(19)9-13;1-11(12-6-4-7-14(18)9-12)19-17(21)16-10-13-5-2-3-8-15(13)20-16;1-10-7-8-15(20-10)11(2)17-16(19)14-9-12-5-3-4-6-13(12)18-14;17-14(15-9-11-5-3-7-18-11)13-8-10-4-1-2-6-12(10)16-13/h1-8,11,13,18,21H,9-10H2,(H,22,23);3-10,12,21H,1-2H3,(H,20,22);2-11,20H,1H3,(H,19,21);3-9,11,18H,1-2H3,(H,17,19);1-8,16H,9H2,(H,15,17)
InChIKeyOGQZMOIZLLONEM-UHFFFAOYSA-N
MW1428.12 g/mol
LogP19.33
Rot. Bonds16

About N-[1-(3-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl(phenyl)methyl]-4-fluoro-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide;N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide

N-[1-(3-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl(phenyl)methyl]-4-fluoro-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide;N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide (PubChem CID 159988728) has the molecular formula C84H77ClF2N10O6S and a molecular weight of 1428.12 g/mol. Its IUPAC name is N-[1-(3-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl(phenyl)methyl]-4-fluoro-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide;N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[1-(3-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl(phenyl)methyl]-4-fluoro-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide;N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide
PubChem CID159988728
Molecular FormulaC84H77ClF2N10O6S
Molecular Weight1428.12 g/mol
Exact Mass1426.54
IUPAC NameN-[1-(3-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl(phenyl)methyl]-4-fluoro-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide;N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide
SMILESCC(NC(=O)c1cc2ccccc2[nH]1)c1cccc(Cl)c1.Cc1ccc(C(C)NC(=O)c2cc3ccccc3[nH]2)o1.Cc1ccc2[nH]c(C(=O)NC(C)c3cccc(F)c3)cc2c1.O=C(NC(c1ccccc1)C1CC1)c1cc2c(F)cccc2[nH]1.O=C(NCc1cccs1)c1cc2ccccc2[nH]1
InChIInChI=1S/C19H17FN2O.C18H17FN2O.C17H15ClN2O.C16H16N2O2.C14H12N2OS/c20-15-7-4-8-16-14(15)11-17(21-16)19(23)22-18(13-9-10-13)12-5-2-1-3-6-12;1-11-6-7-16-14(8-11)10-17(21-16)18(22)20-12(2)13-4-3-5-15(19)9-13;1-11(12-6-4-7-14(18)9-12)19-17(21)16-10-13-5-2-3-8-15(13)20-16;1-10-7-8-15(20-10)11(2)17-16(19)14-9-12-5-3-4-6-13(12)18-14;17-14(15-9-11-5-3-7-18-11)13-8-10-4-1-2-6-12(10)16-13/h1-8,11,13,18,21H,9-10H2,(H,22,23);3-10,12,21H,1-2H3,(H,20,22);2-11,20H,1H3,(H,19,21);3-9,11,18H,1-2H3,(H,17,19);1-8,16H,9H2,(H,15,17)
InChIKeyOGQZMOIZLLONEM-UHFFFAOYSA-N
XLogP19.33
TPSA237.59 Ų
H-Bond Donors10
H-Bond Acceptors7
Rotatable Bonds16
Heavy Atoms104
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001428.12
LogP ≤ 519.33
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 107

Analyze N-[1-(3-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl(phenyl)methyl]-4-fluoro-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide;N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide with MolForge

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Related Compounds

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
4-chloro-5-methyl-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;5-methyl-N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide;4-methyl-1-(5-methyl-1H-indol-2-yl)-3-thiophen-2-ylpentan-1-one;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide
CID 159169057
5-chloro-N-[1-[4-[2-(dimethylamino)ethoxy]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(2-methoxyethoxy)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-methyl-1-phenylpropyl)-1H-indole-2-carboxamide;5-chloro-N-(1-phenylpropyl)-1H-indole-2-carboxamide;(3S)-1-(6-methoxy-1H-indol-2-yl)-3-phenylbutan-1-one;5-N-methyl-2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;N-[(1R)-1-phenylethyl]-5-(trifluoromethyl)-1H-indole-2-carboxamide
CID 161369133
5-chloro-N-[(4-fluorophenyl)methyl]-1H-indole-2-carboxamide;N-[(3-chlorophenyl)methyl]-1H-indole-2-carboxamide;5-fluoro-N-[(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[(4-fluorophenyl)methyl]-5-methyl-1H-indole-2-carboxamide;5-methyl-N-(1-phenylethyl)-1H-indole-2-carboxamide
CID 157079970
N-benzyl-1H-indole-2-carboxamide;N-[(4-chlorophenyl)methyl]-1H-indole-2-carboxamide;5-chloro-N-(pyridin-4-ylmethyl)-1H-indole-2-carboxamide;N-[cyclopropyl(phenyl)methyl]-4-fluoro-1H-indole-2-carboxamide;5-fluoro-N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide
CID 157382807
5-chloro-N-(1-phenylethyl)-1H-indole-2-carboxamide;4,5-dichloro-N-(1-pyridin-3-ylethyl)-1H-indole-2-carboxamide;5-fluoro-N-[1-(3-fluorophenyl)ethyl]-1H-indole-2-carboxamide;1-(5-fluoro-1H-indol-2-yl)-4-methyl-3-thiophen-2-ylpentan-1-one;5-fluoro-N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide
CID 158038713
5-chloro-N-[(4-fluorophenyl)methyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylethyl)-1H-indole-2-carboxamide;5-fluoro-N-[1-(3-fluorophenyl)ethyl]-1H-indole-2-carboxamide;1-(5-fluoro-1H-indol-2-yl)-4-methyl-3-thiophen-2-ylpentan-1-one;5-fluoro-N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide;N-[(4-fluorophenyl)methyl]-5-methyl-1H-indole-2-carboxamide;5-methyl-N-(1-phenylethyl)-1H-indole-2-carboxamide
CID 159507150
N-[2-[2-(1-benzofuran-2-yl)-5-methoxy-1H-indol-3-yl]ethyl]acetamide;N-[2-[2-(1-benzothiophen-2-yl)-5-methoxy-1H-indol-3-yl]ethyl]acetamide;N-[2-[2-(1-benzothiophen-3-yl)-5-methoxy-1H-indol-3-yl]ethyl]acetamide;N-[2-[2-(5-chlorothiophen-2-yl)-5-methoxy-1H-indol-3-yl]ethyl]acetamide;N-[2-[2-(2-formylthiophen-3-yl)-5-methoxy-1H-indol-3-yl]ethyl]acetamide;N-[2-[2-(3-formylthiophen-2-yl)-5-methoxy-1H-indol-3-yl]ethyl]acetamide;N-[2-[2-(5-formylthiophen-2-yl)-5-methoxy-1H-indol-3-yl]ethyl]acetamide;N-[2-[5-methoxy-2-(5-methylthiophen-2-yl)-1H-indol-3-yl]ethyl]acetamide;N-[2-[5-methoxy-2-(2,3,5,6-tetramethylphenyl)-1H-indol-3-yl]ethyl]acetamide;N-[2-(5-methoxy-2-thiophen-3-yl-1H-indol-3-yl)ethyl]acetamide
CID 159515529
N-[1-(3-chlorophenyl)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-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide
CID 159633323
5-chloro-N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[(3-chlorophenyl)methyl]-1H-indole-2-carboxamide;5-fluoro-N-[(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[(4-fluorophenyl)methyl]-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
CID 161030632
N-benzyl-1H-indole-2-carboxamide;N-[1-(3-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[(4-chlorophenyl)methyl]-1H-indole-2-carboxamide;N-[cyclopropyl(phenyl)methyl]-4-fluoro-1H-indole-2-carboxamide;N-[(5R)-2-(dimethylamino)-5,6,7,8-tetrahydroquinazolin-5-yl]-5-fluoro-1H-indole-2-carboxamide;N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide;N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide
CID 161874986
5-chloro-N-[(3-chlorophenyl)methyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[cyclopropyl(phenyl)methyl]-4-fluoro-1H-indole-2-carboxamide;5-fluoro-N-[(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;5-fluoro-N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;N-[(4-fluorophenyl)methyl]-5-methyl-1H-indole-2-carboxamide
CID 161969984

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl(phenyl)methyl]-4-fluoro-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide;N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide?
The IUPAC name of N-[1-(3-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl(phenyl)methyl]-4-fluoro-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide;N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide (CID 159988728) is N-[1-(3-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl(phenyl)methyl]-4-fluoro-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide;N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide.
What is the SMILES notation for N-[1-(3-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl(phenyl)methyl]-4-fluoro-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide;N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide?
The canonical SMILES for N-[1-(3-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl(phenyl)methyl]-4-fluoro-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide;N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide is CC(NC(=O)c1cc2ccccc2[nH]1)c1cccc(Cl)c1.Cc1ccc(C(C)NC(=O)c2cc3ccccc3[nH]2)o1.Cc1ccc2[nH]c(C(=O)NC(C)c3cccc(F)c3)cc2c1.O=C(NC(c1ccccc1)C1CC1)c1cc2c(F)cccc2[nH]1.O=C(NCc1cccs1)c1cc2ccccc2[nH]1.
What is the InChIKey of N-[1-(3-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl(phenyl)methyl]-4-fluoro-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide;N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide?
The InChIKey is OGQZMOIZLLONEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN2O.C18H17FN2O.C17H15ClN2O.C16H16N2O2.C14H12N2OS/c20-15-7-4-8-16-14(15)11-17(21-16)19(23)22-18(13-9-10-13)12-5-2-1-3-6-12;1-11-6-7-16-14(8-11)10-17(21-16)18(22)20-12(2)13-4-3-5-15(19)9-13;1-11(12-6-4-7-14(18)9-12)19-17(21)16-10-13-5-2-3-8-15(13)20-16;1-10-7-8-15(20-10)11(2)17-16(19)14-9-12-5-3-4-6-13(12)18-14;17-14(15-9-11-5-3-7-18-11)13-8-10-4-1-2-6-12(10)16-13/h1-8,11,13,18,21H,9-10H2,(H,22,23);3-10,12,21H,1-2H3,(H,20,22);2-11,20H,1H3,(H,19,21);3-9,11,18H,1-2H3,(H,17,19);1-8,16H,9H2,(H,15,17).
What are the key properties of N-[1-(3-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl(phenyl)methyl]-4-fluoro-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide;N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide?
N-[1-(3-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl(phenyl)methyl]-4-fluoro-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide;N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide has a molecular weight of 1428.12 g/mol, XLogP of 19.33, 16 rotatable bonds, 10 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-chlorophenyl)ethyl]-1H-indole-2-carboxamide;N-[cyclopropyl(phenyl)methyl]-4-fluoro-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-2-carboxamide;N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 159988728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).