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

C14H17N5O2S — CID 56711197

IUPAC7-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide
SMILESCC(C)c1csc(C(=O)N2CCn3c(C(N)=O)cnc3C2)n1
InChIInChI=1S/C14H17N5O2S/c1-8(2)9-7-22-13(17-9)14(21)18-3-4-19-10(12(15)20)5-16-11(19)6-18/h5,7-8H,3-4,6H2,1-2H3,(H2,15,20)
InChIKeyFFEQRNUMJKAYIF-UHFFFAOYSA-N
MW319.39 g/mol
LogP1.22
Rot. Bonds3

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

7-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide (PubChem CID 56711197) has the molecular formula C14H17N5O2S and a molecular weight of 319.39 g/mol. Its IUPAC name is 7-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide.

Molecular Properties

Compound Name7-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide
PubChem CID56711197
Molecular FormulaC14H17N5O2S
Molecular Weight319.39 g/mol
Exact Mass319.11
IUPAC Name7-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide
SMILESCC(C)c1csc(C(=O)N2CCn3c(C(N)=O)cnc3C2)n1
InChIInChI=1S/C14H17N5O2S/c1-8(2)9-7-22-13(17-9)14(21)18-3-4-19-10(12(15)20)5-16-11(19)6-18/h5,7-8H,3-4,6H2,1-2H3,(H2,15,20)
InChIKeyFFEQRNUMJKAYIF-UHFFFAOYSA-N
XLogP1.22
TPSA94.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.39
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide?
The IUPAC name of 7-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide (CID 56711197) is 7-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide.
What is the SMILES notation for 7-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide?
The canonical SMILES for 7-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide is CC(C)c1csc(C(=O)N2CCn3c(C(N)=O)cnc3C2)n1.
What is the InChIKey of 7-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide?
The InChIKey is FFEQRNUMJKAYIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O2S/c1-8(2)9-7-22-13(17-9)14(21)18-3-4-19-10(12(15)20)5-16-11(19)6-18/h5,7-8H,3-4,6H2,1-2H3,(H2,15,20).
What are the key properties of 7-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide?
7-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide has a molecular weight of 319.39 g/mol, XLogP of 1.22, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-propan-2-yl-1,3-thiazole-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-3-carboxamide is sourced from PubChem (CID 56711197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).