[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]cyclohexyl]-piperidin-1-ylmethanone

C30H37N5O — CID 150448803

About [4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]cyclohexyl]-piperidin-1-ylmethanone

[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]cyclohexyl]-piperidin-1-ylmethanone (PubChem CID 150448803) has the molecular formula C30H37N5O and a molecular weight of 483.66 g/mol. Its IUPAC name is [4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]cyclohexyl]-piperidin-1-ylmethanone.

Molecular Properties

• Compound Name: [4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]cyclohexyl]-piperidin-1-ylmethanone
• PubChem CID: 150448803
• Molecular Formula: C30H37N5O
• Molecular Weight: 483.66 g/mol
• Exact Mass: 483.30
• IUPAC Name: [4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]cyclohexyl]-piperidin-1-ylmethanone
• SMILES: Cc1cc(-c2[nH]c3ccc(C4CCC(C(=O)N5CCCCC5)CC4)cc3c2C(C)C)cn2ncnc12
• InChI: InChI=1S/C30H37N5O/c1-19(2)27-25-16-23(21-7-9-22(10-8-21)30(36)34-13-5-4-6-14-34)11-12-26(25)33-28(27)24-15-20(3)29-31-18-32-35(29)17-24/h11-12,15-19,21-22,33H,4-10,13-14H2,1-3H3
• InChIKey: HNINYOGGWLGUOE-UHFFFAOYSA-N
• XLogP: 6.60
• TPSA: 66.29 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 4
• Heavy Atoms: 36
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	483.66
LogP ≤ 5	6.60
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of [4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]cyclohexyl]-piperidin-1-ylmethanone?

The IUPAC name of [4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]cyclohexyl]-piperidin-1-ylmethanone (CID 150448803) is [4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]cyclohexyl]-piperidin-1-ylmethanone.

What is the SMILES notation for [4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]cyclohexyl]-piperidin-1-ylmethanone?

The canonical SMILES for [4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]cyclohexyl]-piperidin-1-ylmethanone is Cc1cc(-c2[nH]c3ccc(C4CCC(C(=O)N5CCCCC5)CC4)cc3c2C(C)C)cn2ncnc12.

What is the InChIKey of [4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]cyclohexyl]-piperidin-1-ylmethanone?

The InChIKey is HNINYOGGWLGUOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H37N5O/c1-19(2)27-25-16-23(21-7-9-22(10-8-21)30(36)34-13-5-4-6-14-34)11-12-26(25)33-28(27)24-15-20(3)29-31-18-32-35(29)17-24/h11-12,15-19,21-22,33H,4-10,13-14H2,1-3H3.

What are the key properties of [4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]cyclohexyl]-piperidin-1-ylmethanone?

[4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]cyclohexyl]-piperidin-1-ylmethanone has a molecular weight of 483.66 g/mol, XLogP of 6.60, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for [4-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-propan-2-yl-1H-indol-5-yl]cyclohexyl]-piperidin-1-ylmethanone is sourced from PubChem (CID 150448803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).