5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-hydroxy-1-phenylethyl)-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-methoxyethyl(methyl)carbamoyl]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(4-methylpiperazine-1-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide

C139H140Cl5N21O15 — CID 159134162

IUPAC5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-hydroxy-1-phenylethyl)-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-methoxyethyl(methyl)carbamoyl]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(4-methylpiperazine-1-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide
SMILESCC(NC(=O)c1cc2cc(C(N)=O)ccc2[nH]1)c1ccccc1.CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccc(C(=O)N2CCN(C)CC2)cc1.CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccc(C(=O)N2CCOCC2)cc1.CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccc(N(C)C)cc1.CC(NC(=O)c1cc2ccc(C(N)=O)cc2[nH]1)c1ccccc1.COCCN(C)C(=O)c1ccc(C(C)NC(=O)c2cc3cc(Cl)ccc3[nH]2)cc1.O=C(NC(CO)c1ccccc1)c1cc2cc(Cl)ccc2[nH]1
InChIInChI=1S/C23H25ClN4O2.C22H22ClN3O3.C22H24ClN3O3.C19H20ClN3O.2C18H17N3O2.C17H15ClN2O2/c1-15(25-22(29)21-14-18-13-19(24)7-8-20(18)26-21)16-3-5-17(6-4-16)23(30)28-11-9-27(2)10-12-28;1-14(24-21(27)20-13-17-12-18(23)6-7-19(17)25-20)15-2-4-16(5-3-15)22(28)26-8-10-29-11-9-26;1-14(15-4-6-16(7-5-15)22(28)26(2)10-11-29-3)24-21(27)20-13-17-12-18(23)8-9-19(17)25-20;1-12(13-4-7-16(8-5-13)23(2)3)21-19(24)18-11-14-10-15(20)6-9-17(14)22-18;1-11(12-5-3-2-4-6-12)20-18(23)16-10-14-9-13(17(19)22)7-8-15(14)21-16;1-11(12-5-3-2-4-6-12)20-18(23)16-9-13-7-8-14(17(19)22)10-15(13)21-16;18-13-6-7-14-12(8-13)9-15(19-14)17(22)20-16(10-21)11-4-2-1-3-5-11/h3-8,13-15,26H,9-12H2,1-2H3,(H,25,29);2-7,12-14,25H,8-11H2,1H3,(H,24,27);4-9,12-14,25H,10-11H2,1-3H3,(H,24,27);4-12,22H,1-3H3,(H,21,24);2*2-11,21H,1H3,(H2,19,22)(H,20,23);1-9,16,19,21H,10H2,(H,20,22)
InChIKeyKHGPOPHCHQRGJF-UHFFFAOYSA-N
MW2522.05 g/mol
LogP24.69
Rot. Bonds31

About 5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-hydroxy-1-phenylethyl)-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-methoxyethyl(methyl)carbamoyl]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(4-methylpiperazine-1-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide

5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-hydroxy-1-phenylethyl)-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-methoxyethyl(methyl)carbamoyl]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(4-methylpiperazine-1-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide (PubChem CID 159134162) has the molecular formula C139H140Cl5N21O15 and a molecular weight of 2522.05 g/mol. Its IUPAC name is 5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-hydroxy-1-phenylethyl)-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-methoxyethyl(methyl)carbamoyl]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(4-methylpiperazine-1-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide.

Molecular Properties

Compound Name5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-hydroxy-1-phenylethyl)-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-methoxyethyl(methyl)carbamoyl]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(4-methylpiperazine-1-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide
PubChem CID159134162
Molecular FormulaC139H140Cl5N21O15
Molecular Weight2522.05 g/mol
Exact Mass2517.93
IUPAC Name5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-hydroxy-1-phenylethyl)-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-methoxyethyl(methyl)carbamoyl]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(4-methylpiperazine-1-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide
SMILESCC(NC(=O)c1cc2cc(C(N)=O)ccc2[nH]1)c1ccccc1.CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccc(C(=O)N2CCN(C)CC2)cc1.CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccc(C(=O)N2CCOCC2)cc1.CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccc(N(C)C)cc1.CC(NC(=O)c1cc2ccc(C(N)=O)cc2[nH]1)c1ccccc1.COCCN(C)C(=O)c1ccc(C(C)NC(=O)c2cc3cc(Cl)ccc3[nH]2)cc1.O=C(NC(CO)c1ccccc1)c1cc2cc(Cl)ccc2[nH]1
InChIInChI=1S/C23H25ClN4O2.C22H22ClN3O3.C22H24ClN3O3.C19H20ClN3O.2C18H17N3O2.C17H15ClN2O2/c1-15(25-22(29)21-14-18-13-19(24)7-8-20(18)26-21)16-3-5-17(6-4-16)23(30)28-11-9-27(2)10-12-28;1-14(24-21(27)20-13-17-12-18(23)6-7-19(17)25-20)15-2-4-16(5-3-15)22(28)26-8-10-29-11-9-26;1-14(15-4-6-16(7-5-15)22(28)26(2)10-11-29-3)24-21(27)20-13-17-12-18(23)8-9-19(17)25-20;1-12(13-4-7-16(8-5-13)23(2)3)21-19(24)18-11-14-10-15(20)6-9-17(14)22-18;1-11(12-5-3-2-4-6-12)20-18(23)16-10-14-9-13(17(19)22)7-8-15(14)21-16;1-11(12-5-3-2-4-6-12)20-18(23)16-9-13-7-8-14(17(19)22)10-15(13)21-16;18-13-6-7-14-12(8-13)9-15(19-14)17(22)20-16(10-21)11-4-2-1-3-5-11/h3-8,13-15,26H,9-12H2,1-2H3,(H,25,29);2-7,12-14,25H,8-11H2,1H3,(H,24,27);4-9,12-14,25H,10-11H2,1-3H3,(H,24,27);4-12,22H,1-3H3,(H,21,24);2*2-11,21H,1H3,(H2,19,22)(H,20,23);1-9,16,19,21H,10H2,(H,20,22)
InChIKeyKHGPOPHCHQRGJF-UHFFFAOYSA-N
XLogP24.69
TPSA506.51 Ų
H-Bond Donors17
H-Bond Acceptors17
Rotatable Bonds31
Heavy Atoms180
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002522.05
LogP ≤ 524.69
H-Bond Donors ≤ 517
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Analyze 5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-hydroxy-1-phenylethyl)-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-methoxyethyl(methyl)carbamoyl]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(4-methylpiperazine-1-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-hydroxy-1-phenylethyl)-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-methoxyethyl(methyl)carbamoyl]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(4-methylpiperazine-1-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide?
The IUPAC name of 5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-hydroxy-1-phenylethyl)-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-methoxyethyl(methyl)carbamoyl]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(4-methylpiperazine-1-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide (CID 159134162) is 5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-hydroxy-1-phenylethyl)-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-methoxyethyl(methyl)carbamoyl]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(4-methylpiperazine-1-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide.
What is the SMILES notation for 5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-hydroxy-1-phenylethyl)-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-methoxyethyl(methyl)carbamoyl]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(4-methylpiperazine-1-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide?
The canonical SMILES for 5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-hydroxy-1-phenylethyl)-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-methoxyethyl(methyl)carbamoyl]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(4-methylpiperazine-1-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide is CC(NC(=O)c1cc2cc(C(N)=O)ccc2[nH]1)c1ccccc1.CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccc(C(=O)N2CCN(C)CC2)cc1.CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccc(C(=O)N2CCOCC2)cc1.CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccc(N(C)C)cc1.CC(NC(=O)c1cc2ccc(C(N)=O)cc2[nH]1)c1ccccc1.COCCN(C)C(=O)c1ccc(C(C)NC(=O)c2cc3cc(Cl)ccc3[nH]2)cc1.O=C(NC(CO)c1ccccc1)c1cc2cc(Cl)ccc2[nH]1.
What is the InChIKey of 5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-hydroxy-1-phenylethyl)-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-methoxyethyl(methyl)carbamoyl]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(4-methylpiperazine-1-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide?
The InChIKey is KHGPOPHCHQRGJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25ClN4O2.C22H22ClN3O3.C22H24ClN3O3.C19H20ClN3O.2C18H17N3O2.C17H15ClN2O2/c1-15(25-22(29)21-14-18-13-19(24)7-8-20(18)26-21)16-3-5-17(6-4-16)23(30)28-11-9-27(2)10-12-28;1-14(24-21(27)20-13-17-12-18(23)6-7-19(17)25-20)15-2-4-16(5-3-15)22(28)26-8-10-29-11-9-26;1-14(15-4-6-16(7-5-15)22(28)26(2)10-11-29-3)24-21(27)20-13-17-12-18(23)8-9-19(17)25-20;1-12(13-4-7-16(8-5-13)23(2)3)21-19(24)18-11-14-10-15(20)6-9-17(14)22-18;1-11(12-5-3-2-4-6-12)20-18(23)16-10-14-9-13(17(19)22)7-8-15(14)21-16;1-11(12-5-3-2-4-6-12)20-18(23)16-9-13-7-8-14(17(19)22)10-15(13)21-16;18-13-6-7-14-12(8-13)9-15(19-14)17(22)20-16(10-21)11-4-2-1-3-5-11/h3-8,13-15,26H,9-12H2,1-2H3,(H,25,29);2-7,12-14,25H,8-11H2,1H3,(H,24,27);4-9,12-14,25H,10-11H2,1-3H3,(H,24,27);4-12,22H,1-3H3,(H,21,24);2*2-11,21H,1H3,(H2,19,22)(H,20,23);1-9,16,19,21H,10H2,(H,20,22).
What are the key properties of 5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-hydroxy-1-phenylethyl)-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-methoxyethyl(methyl)carbamoyl]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(4-methylpiperazine-1-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide?
5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-hydroxy-1-phenylethyl)-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-methoxyethyl(methyl)carbamoyl]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(4-methylpiperazine-1-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide has a molecular weight of 2522.05 g/mol, XLogP of 24.69, 31 rotatable bonds, 17 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(2-hydroxy-1-phenylethyl)-1H-indole-2-carboxamide;5-chloro-N-[1-[4-[2-methoxyethyl(methyl)carbamoyl]phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(4-methylpiperazine-1-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide is sourced from PubChem (CID 159134162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).