2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[1-(pyridin-2-ylmethyl)pyrazol-3-yl]furan-3-carboxamide

C24H23N5O2 — CID 56561940

About 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[1-(pyridin-2-ylmethyl)pyrazol-3-yl]furan-3-carboxamide

2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[1-(pyridin-2-ylmethyl)pyrazol-3-yl]furan-3-carboxamide (PubChem CID 56561940) has the molecular formula C24H23N5O2 and a molecular weight of 413.48 g/mol. Its IUPAC name is 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[1-(pyridin-2-ylmethyl)pyrazol-3-yl]furan-3-carboxamide.

Molecular Properties

• Compound Name: 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[1-(pyridin-2-ylmethyl)pyrazol-3-yl]furan-3-carboxamide
• PubChem CID: 56561940
• Molecular Formula: C24H23N5O2
• Molecular Weight: 413.48 g/mol
• Exact Mass: 413.19
• IUPAC Name: 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[1-(pyridin-2-ylmethyl)pyrazol-3-yl]furan-3-carboxamide
• SMILES: CC1Cc2ccccc2N1Cc1occc1C(=O)Nc1ccn(Cc2ccccn2)n1
• InChI: InChI=1S/C24H23N5O2/c1-17-14-18-6-2-3-8-21(18)29(17)16-22-20(10-13-31-22)24(30)26-23-9-12-28(27-23)15-19-7-4-5-11-25-19/h2-13,17H,14-16H2,1H3,(H,26,27,30)
• InChIKey: UPHZOEKOXXDCTD-UHFFFAOYSA-N
• XLogP: 4.12
• TPSA: 76.19 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	413.48
LogP ≤ 5	4.12
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[1-(pyridin-2-ylmethyl)pyrazol-3-yl]furan-3-carboxamide?

The IUPAC name of 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[1-(pyridin-2-ylmethyl)pyrazol-3-yl]furan-3-carboxamide (CID 56561940) is 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[1-(pyridin-2-ylmethyl)pyrazol-3-yl]furan-3-carboxamide.

What is the SMILES notation for 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[1-(pyridin-2-ylmethyl)pyrazol-3-yl]furan-3-carboxamide?

The canonical SMILES for 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[1-(pyridin-2-ylmethyl)pyrazol-3-yl]furan-3-carboxamide is CC1Cc2ccccc2N1Cc1occc1C(=O)Nc1ccn(Cc2ccccn2)n1.

What is the InChIKey of 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[1-(pyridin-2-ylmethyl)pyrazol-3-yl]furan-3-carboxamide?

The InChIKey is UPHZOEKOXXDCTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N5O2/c1-17-14-18-6-2-3-8-21(18)29(17)16-22-20(10-13-31-22)24(30)26-23-9-12-28(27-23)15-19-7-4-5-11-25-19/h2-13,17H,14-16H2,1H3,(H,26,27,30).

What are the key properties of 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[1-(pyridin-2-ylmethyl)pyrazol-3-yl]furan-3-carboxamide?

2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[1-(pyridin-2-ylmethyl)pyrazol-3-yl]furan-3-carboxamide has a molecular weight of 413.48 g/mol, XLogP of 4.12, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[1-(pyridin-2-ylmethyl)pyrazol-3-yl]furan-3-carboxamide is sourced from PubChem (CID 56561940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).