5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylpropan-2-yl)-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide

C95H93Cl3N14O9 — CID 159458202

About 5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylpropan-2-yl)-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-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylpropan-2-yl)-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide (PubChem CID 159458202) has the molecular formula C95H93Cl3N14O9 and a molecular weight of 1681.24 g/mol. Its IUPAC name is 5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylpropan-2-yl)-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 Name: 5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylpropan-2-yl)-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide
• PubChem CID: 159458202
• Molecular Formula: C95H93Cl3N14O9
• Molecular Weight: 1681.24 g/mol
• Exact Mass: 1678.63
• IUPAC Name: 5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylpropan-2-yl)-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide
• SMILES: CC(Cc1ccccc1)NC(=O)c1cc2cc(Cl)ccc2[nH]1.CC(NC(=O)c1cc2cc(C(N)=O)ccc2[nH]1)c1ccccc1.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
• InChI: InChI=1S/C22H22ClN3O3.C19H20ClN3O.C18H17ClN2O.2C18H17N3O2/c1-14(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;1-12(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;1-12(9-13-5-3-2-4-6-13)20-18(22)17-11-14-10-15(19)7-8-16(14)21-17;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/h2-7,12-14,25H,8-11H2,1H3,(H,24,27);4-12,22H,1-3H3,(H,21,24);2-8,10-12,21H,9H2,1H3,(H,20,22);2*2-11,21H,1H3,(H2,19,22)(H,20,23)
• InChIKey: LUGDEHJJVVHDEK-UHFFFAOYSA-N
• XLogP: 17.86
• TPSA: 343.41 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 10
• Rotatable Bonds: 20
• Heavy Atoms: 121
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1681.24
LogP ≤ 5	17.86
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	10

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylpropan-2-yl)-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-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylpropan-2-yl)-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide (CID 159458202) is 5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylpropan-2-yl)-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-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylpropan-2-yl)-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-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylpropan-2-yl)-1H-indole-2-carboxamide;2-N-(1-phenylethyl)-1H-indole-2,5-dicarboxamide;2-N-(1-phenylethyl)-1H-indole-2,6-dicarboxamide is CC(Cc1ccccc1)NC(=O)c1cc2cc(Cl)ccc2[nH]1.CC(NC(=O)c1cc2cc(C(N)=O)ccc2[nH]1)c1ccccc1.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.

What is the InChIKey of 5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylpropan-2-yl)-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 LUGDEHJJVVHDEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22ClN3O3.C19H20ClN3O.C18H17ClN2O.2C18H17N3O2/c1-14(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;1-12(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;1-12(9-13-5-3-2-4-6-13)20-18(22)17-11-14-10-15(19)7-8-16(14)21-17;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/h2-7,12-14,25H,8-11H2,1H3,(H,24,27);4-12,22H,1-3H3,(H,21,24);2-8,10-12,21H,9H2,1H3,(H,20,22);2*2-11,21H,1H3,(H2,19,22)(H,20,23).

What are the key properties of 5-chloro-N-[1-[4-(dimethylamino)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylpropan-2-yl)-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-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylpropan-2-yl)-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 1681.24 g/mol, XLogP of 17.86, 20 rotatable bonds, 12 hydrogen bond donors, and 10 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-[1-[4-(morpholine-4-carbonyl)phenyl]ethyl]-1H-indole-2-carboxamide;5-chloro-N-(1-phenylpropan-2-yl)-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 159458202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).