N-(furan-2-ylmethyl)-8-methyl-7-(1-methylindole-3-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide

C23H23N5O3 — CID 131694067

About N-(furan-2-ylmethyl)-8-methyl-7-(1-methylindole-3-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide

N-(furan-2-ylmethyl)-8-methyl-7-(1-methylindole-3-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide (PubChem CID 131694067) has the molecular formula C23H23N5O3 and a molecular weight of 417.47 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-8-methyl-7-(1-methylindole-3-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide.

Molecular Properties

• Compound Name: N-(furan-2-ylmethyl)-8-methyl-7-(1-methylindole-3-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
• PubChem CID: 131694067
• Molecular Formula: C23H23N5O3
• Molecular Weight: 417.47 g/mol
• Exact Mass: 417.18
• IUPAC Name: N-(furan-2-ylmethyl)-8-methyl-7-(1-methylindole-3-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
• SMILES: CC1c2nc(C(=O)NCc3ccco3)cn2CCN1C(=O)c1cn(C)c2ccccc12
• InChI: InChI=1S/C23H23N5O3/c1-15-21-25-19(22(29)24-12-16-6-5-11-31-16)14-27(21)9-10-28(15)23(30)18-13-26(2)20-8-4-3-7-17(18)20/h3-8,11,13-15H,9-10,12H2,1-2H3,(H,24,29)
• InChIKey: XVYSETBKCBIQIS-UHFFFAOYSA-N
• XLogP: 3.11
• TPSA: 85.30 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	417.47
LogP ≤ 5	3.11
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-8-methyl-7-(1-methylindole-3-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?

The IUPAC name of N-(furan-2-ylmethyl)-8-methyl-7-(1-methylindole-3-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide (CID 131694067) is N-(furan-2-ylmethyl)-8-methyl-7-(1-methylindole-3-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide.

What is the SMILES notation for N-(furan-2-ylmethyl)-8-methyl-7-(1-methylindole-3-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?

The canonical SMILES for N-(furan-2-ylmethyl)-8-methyl-7-(1-methylindole-3-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide is CC1c2nc(C(=O)NCc3ccco3)cn2CCN1C(=O)c1cn(C)c2ccccc12.

What is the InChIKey of N-(furan-2-ylmethyl)-8-methyl-7-(1-methylindole-3-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?

The InChIKey is XVYSETBKCBIQIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N5O3/c1-15-21-25-19(22(29)24-12-16-6-5-11-31-16)14-27(21)9-10-28(15)23(30)18-13-26(2)20-8-4-3-7-17(18)20/h3-8,11,13-15H,9-10,12H2,1-2H3,(H,24,29).

What are the key properties of N-(furan-2-ylmethyl)-8-methyl-7-(1-methylindole-3-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?

N-(furan-2-ylmethyl)-8-methyl-7-(1-methylindole-3-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide has a molecular weight of 417.47 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-(furan-2-ylmethyl)-8-methyl-7-(1-methylindole-3-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide is sourced from PubChem (CID 131694067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).