N-(furan-2-ylmethyl)-2-[8-methyl-7-(pyrazine-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]acetamide

C19H20N6O3 — CID 131694429

IUPACN-(furan-2-ylmethyl)-2-[8-methyl-7-(pyrazine-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]acetamide
SMILESCC1c2nc(CC(=O)NCc3ccco3)cn2CCN1C(=O)c1cnccn1
InChIInChI=1S/C19H20N6O3/c1-13-18-23-14(9-17(26)22-10-15-3-2-8-28-15)12-24(18)6-7-25(13)19(27)16-11-20-4-5-21-16/h2-5,8,11-13H,6-7,9-10H2,1H3,(H,22,26)
InChIKeyJCXXYLQNLXVGKI-UHFFFAOYSA-N
MW380.41 g/mol
LogP1.34
Rot. Bonds5

About N-(furan-2-ylmethyl)-2-[8-methyl-7-(pyrazine-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]acetamide

N-(furan-2-ylmethyl)-2-[8-methyl-7-(pyrazine-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]acetamide (PubChem CID 131694429) has the molecular formula C19H20N6O3 and a molecular weight of 380.41 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-[8-methyl-7-(pyrazine-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]acetamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-[8-methyl-7-(pyrazine-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]acetamide
PubChem CID131694429
Molecular FormulaC19H20N6O3
Molecular Weight380.41 g/mol
Exact Mass380.16
IUPAC NameN-(furan-2-ylmethyl)-2-[8-methyl-7-(pyrazine-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]acetamide
SMILESCC1c2nc(CC(=O)NCc3ccco3)cn2CCN1C(=O)c1cnccn1
InChIInChI=1S/C19H20N6O3/c1-13-18-23-14(9-17(26)22-10-15-3-2-8-28-15)12-24(18)6-7-25(13)19(27)16-11-20-4-5-21-16/h2-5,8,11-13H,6-7,9-10H2,1H3,(H,22,26)
InChIKeyJCXXYLQNLXVGKI-UHFFFAOYSA-N
XLogP1.34
TPSA106.15 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.41
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-[8-methyl-7-(pyrazine-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]acetamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-[8-methyl-7-(pyrazine-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]acetamide (CID 131694429) is N-(furan-2-ylmethyl)-2-[8-methyl-7-(pyrazine-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]acetamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-[8-methyl-7-(pyrazine-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]acetamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-[8-methyl-7-(pyrazine-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]acetamide is CC1c2nc(CC(=O)NCc3ccco3)cn2CCN1C(=O)c1cnccn1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-[8-methyl-7-(pyrazine-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]acetamide?
The InChIKey is JCXXYLQNLXVGKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6O3/c1-13-18-23-14(9-17(26)22-10-15-3-2-8-28-15)12-24(18)6-7-25(13)19(27)16-11-20-4-5-21-16/h2-5,8,11-13H,6-7,9-10H2,1H3,(H,22,26).
What are the key properties of N-(furan-2-ylmethyl)-2-[8-methyl-7-(pyrazine-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]acetamide?
N-(furan-2-ylmethyl)-2-[8-methyl-7-(pyrazine-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]acetamide has a molecular weight of 380.41 g/mol, XLogP of 1.34, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-[8-methyl-7-(pyrazine-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]acetamide is sourced from PubChem (CID 131694429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).