2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]furan-3-carboxamide

C25H28N4O3 — CID 56563441

About 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]furan-3-carboxamide

2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]furan-3-carboxamide (PubChem CID 56563441) has the molecular formula C25H28N4O3 and a molecular weight of 432.52 g/mol. Its IUPAC name is 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]furan-3-carboxamide.

Molecular Properties

• Compound Name: 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]furan-3-carboxamide
• PubChem CID: 56563441
• Molecular Formula: C25H28N4O3
• Molecular Weight: 432.52 g/mol
• Exact Mass: 432.22
• IUPAC Name: 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]furan-3-carboxamide
• SMILES: CC1Cc2ccccc2N1Cc1occc1C(=O)NCc1cccnc1N1CCOCC1
• InChI: InChI=1S/C25H28N4O3/c1-18-15-19-5-2-3-7-22(19)29(18)17-23-21(8-12-32-23)25(30)27-16-20-6-4-9-26-24(20)28-10-13-31-14-11-28/h2-9,12,18H,10-11,13-17H2,1H3,(H,27,30)
• InChIKey: ZVMVBBFJIRIZTP-UHFFFAOYSA-N
• XLogP: 3.39
• TPSA: 70.84 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	432.52
LogP ≤ 5	3.39
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-[(2-morpholin-4-yl-3-pyridinyl)methyl]furan-3-carboxamide?

The IUPAC name of 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]furan-3-carboxamide (CID 56563441) is 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]furan-3-carboxamide.

What is the SMILES notation for 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]furan-3-carboxamide?

The canonical SMILES for 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]furan-3-carboxamide is CC1Cc2ccccc2N1Cc1occc1C(=O)NCc1cccnc1N1CCOCC1.

What is the InChIKey of 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]furan-3-carboxamide?

The InChIKey is ZVMVBBFJIRIZTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N4O3/c1-18-15-19-5-2-3-7-22(19)29(18)17-23-21(8-12-32-23)25(30)27-16-20-6-4-9-26-24(20)28-10-13-31-14-11-28/h2-9,12,18H,10-11,13-17H2,1H3,(H,27,30).

What are the key properties of 2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]furan-3-carboxamide?

2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]furan-3-carboxamide has a molecular weight of 432.52 g/mol, XLogP of 3.39, 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-[(2-morpholin-4-yl-3-pyridinyl)methyl]furan-3-carboxamide is sourced from PubChem (CID 56563441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).