4-[(1S)-1,2-dihydroxyethyl]-6-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1S)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1R)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;4-[(1S)-1,2-dihydroxyethyl]-6-[1-(2-methylpropyl)indol-5-yl]pyridine-2-carboxamide

C92H92N12O12 — CID 158605795

About 4-[(1S)-1,2-dihydroxyethyl]-6-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1S)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1R)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;4-[(1S)-1,2-dihydroxyethyl]-6-[1-(2-methylpropyl)indol-5-yl]pyridine-2-carboxamide

4-[(1S)-1,2-dihydroxyethyl]-6-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1S)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1R)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;4-[(1S)-1,2-dihydroxyethyl]-6-[1-(2-methylpropyl)indol-5-yl]pyridine-2-carboxamide (PubChem CID 158605795) has the molecular formula C92H92N12O12 and a molecular weight of 1557.82 g/mol. Its IUPAC name is 4-[(1S)-1,2-dihydroxyethyl]-6-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1S)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1R)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;4-[(1S)-1,2-dihydroxyethyl]-6-[1-(2-methylpropyl)indol-5-yl]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: 4-[(1S)-1,2-dihydroxyethyl]-6-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1S)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1R)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;4-[(1S)-1,2-dihydroxyethyl]-6-[1-(2-methylpropyl)indol-5-yl]pyridine-2-carboxamide
• PubChem CID: 158605795
• Molecular Formula: C92H92N12O12
• Molecular Weight: 1557.82 g/mol
• Exact Mass: 1556.70
• IUPAC Name: 4-[(1S)-1,2-dihydroxyethyl]-6-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1S)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1R)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;4-[(1S)-1,2-dihydroxyethyl]-6-[1-(2-methylpropyl)indol-5-yl]pyridine-2-carboxamide
• SMILES: CC(C)Cn1ccc2cc(-c3cc([C@H](O)CO)cc(C(N)=O)n3)ccc21.Cc1ccc(Cn2ccc3cc(-c4cc(C(N)=O)nc([C@@H](O)CO)c4)ccc32)cc1.Cc1ccc(Cn2ccc3cc(-c4cc(C(N)=O)nc([C@H](O)CO)c4)ccc32)cc1.Cc1ccc(Cn2ccc3cc(-c4cc([C@H](O)CO)cc(C(N)=O)n4)ccc32)cc1
• InChI: InChI=1S/3C24H23N3O3.C20H23N3O3/c1-15-2-4-16(5-3-15)13-27-9-8-18-10-17(6-7-22(18)27)20-11-19(23(29)14-28)12-21(26-20)24(25)30;2*1-15-2-4-16(5-3-15)13-27-9-8-18-10-17(6-7-22(18)27)19-11-20(23(29)14-28)26-21(12-19)24(25)30;1-12(2)10-23-6-5-14-7-13(3-4-18(14)23)16-8-15(19(25)11-24)9-17(22-16)20(21)26/h3*2-12,23,28-29H,13-14H2,1H3,(H2,25,30);3-9,12,19,24-25H,10-11H2,1-2H3,(H2,21,26)/t3*23-;19-/m1101/s1
• InChIKey: HWEZAOYLAQNOHS-GHKRAPMHSA-N
• XLogP: 12.04
• TPSA: 405.48 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 20
• Rotatable Bonds: 24
• Heavy Atoms: 116
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1557.82
LogP ≤ 5	12.04
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

What is the IUPAC name of 4-[(1S)-1,2-dihydroxyethyl]-6-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1S)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1R)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;4-[(1S)-1,2-dihydroxyethyl]-6-[1-(2-methylpropyl)indol-5-yl]pyridine-2-carboxamide?

The IUPAC name of 4-[(1S)-1,2-dihydroxyethyl]-6-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1S)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1R)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;4-[(1S)-1,2-dihydroxyethyl]-6-[1-(2-methylpropyl)indol-5-yl]pyridine-2-carboxamide (CID 158605795) is 4-[(1S)-1,2-dihydroxyethyl]-6-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1S)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1R)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;4-[(1S)-1,2-dihydroxyethyl]-6-[1-(2-methylpropyl)indol-5-yl]pyridine-2-carboxamide.

What is the SMILES notation for 4-[(1S)-1,2-dihydroxyethyl]-6-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1S)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1R)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;4-[(1S)-1,2-dihydroxyethyl]-6-[1-(2-methylpropyl)indol-5-yl]pyridine-2-carboxamide?

The canonical SMILES for 4-[(1S)-1,2-dihydroxyethyl]-6-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1S)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1R)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;4-[(1S)-1,2-dihydroxyethyl]-6-[1-(2-methylpropyl)indol-5-yl]pyridine-2-carboxamide is CC(C)Cn1ccc2cc(-c3cc([C@H](O)CO)cc(C(N)=O)n3)ccc21.Cc1ccc(Cn2ccc3cc(-c4cc(C(N)=O)nc([C@@H](O)CO)c4)ccc32)cc1.Cc1ccc(Cn2ccc3cc(-c4cc(C(N)=O)nc([C@H](O)CO)c4)ccc32)cc1.Cc1ccc(Cn2ccc3cc(-c4cc([C@H](O)CO)cc(C(N)=O)n4)ccc32)cc1.

What is the InChIKey of 4-[(1S)-1,2-dihydroxyethyl]-6-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1S)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1R)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;4-[(1S)-1,2-dihydroxyethyl]-6-[1-(2-methylpropyl)indol-5-yl]pyridine-2-carboxamide?

The InChIKey is HWEZAOYLAQNOHS-GHKRAPMHSA-N. The full InChI is InChI=1S/3C24H23N3O3.C20H23N3O3/c1-15-2-4-16(5-3-15)13-27-9-8-18-10-17(6-7-22(18)27)20-11-19(23(29)14-28)12-21(26-20)24(25)30;2*1-15-2-4-16(5-3-15)13-27-9-8-18-10-17(6-7-22(18)27)19-11-20(23(29)14-28)26-21(12-19)24(25)30;1-12(2)10-23-6-5-14-7-13(3-4-18(14)23)16-8-15(19(25)11-24)9-17(22-16)20(21)26/h3*2-12,23,28-29H,13-14H2,1H3,(H2,25,30);3-9,12,19,24-25H,10-11H2,1-2H3,(H2,21,26)/t3*23-;19-/m1101/s1.

What are the key properties of 4-[(1S)-1,2-dihydroxyethyl]-6-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1S)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1R)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;4-[(1S)-1,2-dihydroxyethyl]-6-[1-(2-methylpropyl)indol-5-yl]pyridine-2-carboxamide?

4-[(1S)-1,2-dihydroxyethyl]-6-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1S)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1R)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;4-[(1S)-1,2-dihydroxyethyl]-6-[1-(2-methylpropyl)indol-5-yl]pyridine-2-carboxamide has a molecular weight of 1557.82 g/mol, XLogP of 12.04, 24 rotatable bonds, 12 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[(1S)-1,2-dihydroxyethyl]-6-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1S)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;6-[(1R)-1,2-dihydroxyethyl]-4-[1-[(4-methylphenyl)methyl]indol-5-yl]pyridine-2-carboxamide;4-[(1S)-1,2-dihydroxyethyl]-6-[1-(2-methylpropyl)indol-5-yl]pyridine-2-carboxamide is sourced from PubChem (CID 158605795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).