(2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]propanamide

C25H31N3O4 — CID 92503745

About (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]propanamide

(2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]propanamide (PubChem CID 92503745) has the molecular formula C25H31N3O4 and a molecular weight of 437.54 g/mol. Its IUPAC name is (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]propanamide.

Molecular Properties

• Compound Name: (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]propanamide
• PubChem CID: 92503745
• Molecular Formula: C25H31N3O4
• Molecular Weight: 437.54 g/mol
• Exact Mass: 437.23
• IUPAC Name: (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]propanamide
• SMILES: COc1ccc2cc(C(=O)N3CCC([C@@H](C)C(=O)N[C@H](C)Cc4ccco4)CC3)[nH]c2c1
• InChI: InChI=1S/C25H31N3O4/c1-16(13-21-5-4-12-32-21)26-24(29)17(2)18-8-10-28(11-9-18)25(30)23-14-19-6-7-20(31-3)15-22(19)27-23/h4-7,12,14-18,27H,8-11,13H2,1-3H3,(H,26,29)/t16-,17-/m1/s1
• InChIKey: RRFMPYPZQRLIEE-IAGOWNOFSA-N
• XLogP: 4.01
• TPSA: 87.57 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 7
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	437.54
LogP ≤ 5	4.01
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]propanamide?

The IUPAC name of (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]propanamide (CID 92503745) is (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]propanamide.

What is the SMILES notation for (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]propanamide?

The canonical SMILES for (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]propanamide is COc1ccc2cc(C(=O)N3CCC([C@@H](C)C(=O)N[C@H](C)Cc4ccco4)CC3)[nH]c2c1.

What is the InChIKey of (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]propanamide?

The InChIKey is RRFMPYPZQRLIEE-IAGOWNOFSA-N. The full InChI is InChI=1S/C25H31N3O4/c1-16(13-21-5-4-12-32-21)26-24(29)17(2)18-8-10-28(11-9-18)25(30)23-14-19-6-7-20(31-3)15-22(19)27-23/h4-7,12,14-18,27H,8-11,13H2,1-3H3,(H,26,29)/t16-,17-/m1/s1.

What are the key properties of (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]propanamide?

(2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]propanamide has a molecular weight of 437.54 g/mol, XLogP of 4.01, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]propanamide is sourced from PubChem (CID 92503745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).