7-(4-ethylthiadiazole-5-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide

C12H14N6O2S — CID 50979978

IUPAC7-(4-ethylthiadiazole-5-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide
SMILESCCc1nnsc1C(=O)N1CCn2c(C(N)=O)cnc2C1
InChIInChI=1S/C12H14N6O2S/c1-2-7-10(21-16-15-7)12(20)17-3-4-18-8(11(13)19)5-14-9(18)6-17/h5H,2-4,6H2,1H3,(H2,13,19)
InChIKeyGYDSRJVSRNZMGK-UHFFFAOYSA-N
MW306.35 g/mol
LogP0.05
Rot. Bonds3

About 7-(4-ethylthiadiazole-5-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide

7-(4-ethylthiadiazole-5-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide (PubChem CID 50979978) has the molecular formula C12H14N6O2S and a molecular weight of 306.35 g/mol. Its IUPAC name is 7-(4-ethylthiadiazole-5-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide.

Molecular Properties

Compound Name7-(4-ethylthiadiazole-5-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide
PubChem CID50979978
Molecular FormulaC12H14N6O2S
Molecular Weight306.35 g/mol
Exact Mass306.09
IUPAC Name7-(4-ethylthiadiazole-5-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide
SMILESCCc1nnsc1C(=O)N1CCn2c(C(N)=O)cnc2C1
InChIInChI=1S/C12H14N6O2S/c1-2-7-10(21-16-15-7)12(20)17-3-4-18-8(11(13)19)5-14-9(18)6-17/h5H,2-4,6H2,1H3,(H2,13,19)
InChIKeyGYDSRJVSRNZMGK-UHFFFAOYSA-N
XLogP0.05
TPSA107.00 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.35
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 7-(4-ethylthiadiazole-5-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide?
The IUPAC name of 7-(4-ethylthiadiazole-5-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide (CID 50979978) is 7-(4-ethylthiadiazole-5-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide.
What is the SMILES notation for 7-(4-ethylthiadiazole-5-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide?
The canonical SMILES for 7-(4-ethylthiadiazole-5-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide is CCc1nnsc1C(=O)N1CCn2c(C(N)=O)cnc2C1.
What is the InChIKey of 7-(4-ethylthiadiazole-5-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide?
The InChIKey is GYDSRJVSRNZMGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N6O2S/c1-2-7-10(21-16-15-7)12(20)17-3-4-18-8(11(13)19)5-14-9(18)6-17/h5H,2-4,6H2,1H3,(H2,13,19).
What are the key properties of 7-(4-ethylthiadiazole-5-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide?
7-(4-ethylthiadiazole-5-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide has a molecular weight of 306.35 g/mol, XLogP of 0.05, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-ethylthiadiazole-5-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide is sourced from PubChem (CID 50979978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).