6-methoxy-N-[2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-1H-indole-2-carboxamide

C24H19N5O3 — CID 90563019

About 6-methoxy-N-[2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-1H-indole-2-carboxamide

6-methoxy-N-[2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-1H-indole-2-carboxamide (PubChem CID 90563019) has the molecular formula C24H19N5O3 and a molecular weight of 425.45 g/mol. Its IUPAC name is 6-methoxy-N-[2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-1H-indole-2-carboxamide.

Molecular Properties

• Compound Name: 6-methoxy-N-[2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-1H-indole-2-carboxamide
• PubChem CID: 90563019
• Molecular Formula: C24H19N5O3
• Molecular Weight: 425.45 g/mol
• Exact Mass: 425.15
• IUPAC Name: 6-methoxy-N-[2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-1H-indole-2-carboxamide
• SMILES: COc1ccc2cc(C(=O)Nc3ccccc3Cc3nc(-c4ccncc4)no3)[nH]c2c1
• InChI: InChI=1S/C24H19N5O3/c1-31-18-7-6-17-12-21(26-20(17)14-18)24(30)27-19-5-3-2-4-16(19)13-22-28-23(29-32-22)15-8-10-25-11-9-15/h2-12,14,26H,13H2,1H3,(H,27,30)
• InChIKey: MQHPFFYFZZEPGI-UHFFFAOYSA-N
• XLogP: 4.46
• TPSA: 105.93 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	425.45
LogP ≤ 5	4.46
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-[2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-1H-indole-2-carboxamide?

The IUPAC name of 6-methoxy-N-[2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-1H-indole-2-carboxamide (CID 90563019) is 6-methoxy-N-[2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-1H-indole-2-carboxamide.

What is the SMILES notation for 6-methoxy-N-[2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-1H-indole-2-carboxamide?

The canonical SMILES for 6-methoxy-N-[2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-1H-indole-2-carboxamide is COc1ccc2cc(C(=O)Nc3ccccc3Cc3nc(-c4ccncc4)no3)[nH]c2c1.

What is the InChIKey of 6-methoxy-N-[2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-1H-indole-2-carboxamide?

The InChIKey is MQHPFFYFZZEPGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N5O3/c1-31-18-7-6-17-12-21(26-20(17)14-18)24(30)27-19-5-3-2-4-16(19)13-22-28-23(29-32-22)15-8-10-25-11-9-15/h2-12,14,26H,13H2,1H3,(H,27,30).

What are the key properties of 6-methoxy-N-[2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-1H-indole-2-carboxamide?

6-methoxy-N-[2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-1H-indole-2-carboxamide has a molecular weight of 425.45 g/mol, XLogP of 4.46, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 6-methoxy-N-[2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methyl]phenyl]-1H-indole-2-carboxamide is sourced from PubChem (CID 90563019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).