5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide

C91H80Cl3FN12O8 — CID 158129622

About 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide

5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide (PubChem CID 158129622) has the molecular formula C91H80Cl3FN12O8 and a molecular weight of 1595.07 g/mol. Its IUPAC name is 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide.

Molecular Properties

• Compound Name: 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide
• PubChem CID: 158129622
• Molecular Formula: C91H80Cl3FN12O8
• Molecular Weight: 1595.07 g/mol
• Exact Mass: 1592.53
• IUPAC Name: 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide
• SMILES: CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccn(-c2ccccc2)n1.COc1ccc2[nH]c(C(=O)N[C@H](C)c3ccccc3)cc2c1.C[C@@H](NC(=O)c1cc2cc(Cl)cc(F)c2[nH]1)c1ccccc1.O=C(CC1(c2ccccc2)COC1)c1cc2cc(Cl)cnc2[nH]1.O=C(NC1(c2ccccc2)CC1)c1cc2ccc(O)cc2[nH]1
• InChI: InChI=1S/C20H17ClN4O.C18H15ClN2O2.C18H16N2O2.C18H18N2O2.C17H14ClFN2O/c1-13(17-9-10-25(24-17)16-5-3-2-4-6-16)22-20(26)19-12-14-11-15(21)7-8-18(14)23-19;19-14-6-12-7-15(21-17(12)20-9-14)16(22)8-18(10-23-11-18)13-4-2-1-3-5-13;21-14-7-6-12-10-16(19-15(12)11-14)17(22)20-18(8-9-18)13-4-2-1-3-5-13;1-12(13-6-4-3-5-7-13)19-18(21)17-11-14-10-15(22-2)8-9-16(14)20-17;1-10(11-5-3-2-4-6-11)20-17(22)15-8-12-7-13(18)9-14(19)16(12)21-15/h2-13,23H,1H3,(H,22,26);1-7,9H,8,10-11H2,(H,20,21);1-7,10-11,19,21H,8-9H2,(H,20,22);3-12,20H,1-2H3,(H,19,21);2-10,21H,1H3,(H,20,22)/t;;;12-;10-/m...11/s1
• InChIKey: FSPMUFSQVHMADE-UPRUJTLQSA-N
• XLogP: 19.67
• TPSA: 281.82 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 11
• Rotatable Bonds: 18
• Heavy Atoms: 115
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1595.07
LogP ≤ 5	19.67
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	11

Frequently Asked Questions

What is the IUPAC name of 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide?

The IUPAC name of 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide (CID 158129622) is 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide.

What is the SMILES notation for 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide?

The canonical SMILES for 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide is CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccn(-c2ccccc2)n1.COc1ccc2[nH]c(C(=O)N[C@H](C)c3ccccc3)cc2c1.C[C@@H](NC(=O)c1cc2cc(Cl)cc(F)c2[nH]1)c1ccccc1.O=C(CC1(c2ccccc2)COC1)c1cc2cc(Cl)cnc2[nH]1.O=C(NC1(c2ccccc2)CC1)c1cc2ccc(O)cc2[nH]1.

What is the InChIKey of 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide?

The InChIKey is FSPMUFSQVHMADE-UPRUJTLQSA-N. The full InChI is InChI=1S/C20H17ClN4O.C18H15ClN2O2.C18H16N2O2.C18H18N2O2.C17H14ClFN2O/c1-13(17-9-10-25(24-17)16-5-3-2-4-6-16)22-20(26)19-12-14-11-15(21)7-8-18(14)23-19;19-14-6-12-7-15(21-17(12)20-9-14)16(22)8-18(10-23-11-18)13-4-2-1-3-5-13;21-14-7-6-12-10-16(19-15(12)11-14)17(22)20-18(8-9-18)13-4-2-1-3-5-13;1-12(13-6-4-3-5-7-13)19-18(21)17-11-14-10-15(22-2)8-9-16(14)20-17;1-10(11-5-3-2-4-6-11)20-17(22)15-8-12-7-13(18)9-14(19)16(12)21-15/h2-13,23H,1H3,(H,22,26);1-7,9H,8,10-11H2,(H,20,21);1-7,10-11,19,21H,8-9H2,(H,20,22);3-12,20H,1-2H3,(H,19,21);2-10,21H,1H3,(H,20,22)/t;;;12-;10-/m...11/s1.

What are the key properties of 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide?

5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide has a molecular weight of 1595.07 g/mol, XLogP of 19.67, 18 rotatable bonds, 10 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for 5-chloro-7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-phenylpyrazol-3-yl)ethyl]-1H-indole-2-carboxamide;1-(5-chloro-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-(3-phenyloxetan-3-yl)ethanone;6-hydroxy-N-(1-phenylcyclopropyl)-1H-indole-2-carboxamide;5-methoxy-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide is sourced from PubChem (CID 158129622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).