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

C17H20N4O3 — CID 131694188

IUPAC7-(cyclobutanecarbonyl)-N-(furan-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide
SMILESO=C(NCc1ccco1)C1CN(C(=O)C2CCC2)Cc2cncn21
InChIInChI=1S/C17H20N4O3/c22-16(19-8-14-5-2-6-24-14)15-10-20(17(23)12-3-1-4-12)9-13-7-18-11-21(13)15/h2,5-7,11-12,15H,1,3-4,8-10H2,(H,19,22)
InChIKeySPDXMLASPLZUAO-UHFFFAOYSA-N
MW328.37 g/mol
LogP1.48
Rot. Bonds4

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

7-(cyclobutanecarbonyl)-N-(furan-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide (PubChem CID 131694188) has the molecular formula C17H20N4O3 and a molecular weight of 328.37 g/mol. Its IUPAC name is 7-(cyclobutanecarbonyl)-N-(furan-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide.

Molecular Properties

Compound Name7-(cyclobutanecarbonyl)-N-(furan-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide
PubChem CID131694188
Molecular FormulaC17H20N4O3
Molecular Weight328.37 g/mol
Exact Mass328.15
IUPAC Name7-(cyclobutanecarbonyl)-N-(furan-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide
SMILESO=C(NCc1ccco1)C1CN(C(=O)C2CCC2)Cc2cncn21
InChIInChI=1S/C17H20N4O3/c22-16(19-8-14-5-2-6-24-14)15-10-20(17(23)12-3-1-4-12)9-13-7-18-11-21(13)15/h2,5-7,11-12,15H,1,3-4,8-10H2,(H,19,22)
InChIKeySPDXMLASPLZUAO-UHFFFAOYSA-N
XLogP1.48
TPSA80.37 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

7-(2-ethoxyacetyl)-N-(furan-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide
CID 131693822
7-(cyclobutanecarbonyl)-N-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide
CID 131694410
trans-(1S,3S)-1-N,3-N-bis(furan-2-ylmethyl)cyclohexane-1,3-dicarboxamide
CID 94798892
(3S)-1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-N-(furan-2-ylmethyl)piperidine-3-carboxamide
CID 95563646
trans-(1R,3R)-3-(furan-2-ylmethylcarbamoyl)cyclohexane-1-carboxylic acid
CID 124510443
4-[2-(furan-2-ylmethylcarbamoyl)pyrrolidine-1-carbonyl]cyclohexane-1-carboxylic acid
CID 120672807
(3S)-3-N-(furan-2-ylmethyl)-1-N-phenylpiperidine-1,3-dicarboxamide
CID 7435298
N-(furan-2-ylmethyl)-1-pyridin-4-ylpiperidine-3-carboxamide
CID 20973198
N-(furan-2-ylmethyl)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide
CID 109131808
2-[4-(cyclohexanecarbonyl)piperazin-1-yl]-N-(furan-2-ylmethyl)acetamide
CID 51094831
(3S)-N-(furan-2-ylmethyl)-1-pyrazin-2-ylpiperidine-3-carboxamide
CID 40639433
7-(furan-3-ylmethyl)-N-(pyridin-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide
CID 131654510

Frequently Asked Questions

What is the IUPAC name of 7-(cyclobutanecarbonyl)-N-(furan-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide?
The IUPAC name of 7-(cyclobutanecarbonyl)-N-(furan-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide (CID 131694188) is 7-(cyclobutanecarbonyl)-N-(furan-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide.
What is the SMILES notation for 7-(cyclobutanecarbonyl)-N-(furan-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide?
The canonical SMILES for 7-(cyclobutanecarbonyl)-N-(furan-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide is O=C(NCc1ccco1)C1CN(C(=O)C2CCC2)Cc2cncn21.
What is the InChIKey of 7-(cyclobutanecarbonyl)-N-(furan-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide?
The InChIKey is SPDXMLASPLZUAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O3/c22-16(19-8-14-5-2-6-24-14)15-10-20(17(23)12-3-1-4-12)9-13-7-18-11-21(13)15/h2,5-7,11-12,15H,1,3-4,8-10H2,(H,19,22).
What are the key properties of 7-(cyclobutanecarbonyl)-N-(furan-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide?
7-(cyclobutanecarbonyl)-N-(furan-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide has a molecular weight of 328.37 g/mol, XLogP of 1.48, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(cyclobutanecarbonyl)-N-(furan-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide is sourced from PubChem (CID 131694188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).