6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-(methylamino)-1,3,4-thiadiazol-2-yl]methanone

C10H12N6OS — CID 80616411

IUPAC6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-(methylamino)-1,3,4-thiadiazol-2-yl]methanone
SMILESCNc1nnc(C(=O)N2CCn3ccnc3C2)s1
InChIInChI=1S/C10H12N6OS/c1-11-10-14-13-8(18-10)9(17)16-5-4-15-3-2-12-7(15)6-16/h2-3H,4-6H2,1H3,(H,11,14)
InChIKeyTWSRZCKZRPFMLJ-UHFFFAOYSA-N
MW264.31 g/mol
LogP0.43
Rot. Bonds2

About 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-(methylamino)-1,3,4-thiadiazol-2-yl]methanone

6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-(methylamino)-1,3,4-thiadiazol-2-yl]methanone (PubChem CID 80616411) has the molecular formula C10H12N6OS and a molecular weight of 264.31 g/mol. Its IUPAC name is 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-(methylamino)-1,3,4-thiadiazol-2-yl]methanone.

Molecular Properties

Compound Name6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-(methylamino)-1,3,4-thiadiazol-2-yl]methanone
PubChem CID80616411
Molecular FormulaC10H12N6OS
Molecular Weight264.31 g/mol
Exact Mass264.08
IUPAC Name6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-(methylamino)-1,3,4-thiadiazol-2-yl]methanone
SMILESCNc1nnc(C(=O)N2CCn3ccnc3C2)s1
InChIInChI=1S/C10H12N6OS/c1-11-10-14-13-8(18-10)9(17)16-5-4-15-3-2-12-7(15)6-16/h2-3H,4-6H2,1H3,(H,11,14)
InChIKeyTWSRZCKZRPFMLJ-UHFFFAOYSA-N
XLogP0.43
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.31
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-(methylamino)-1,3,4-thiadiazol-2-yl]methanone?
The IUPAC name of 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-(methylamino)-1,3,4-thiadiazol-2-yl]methanone (CID 80616411) is 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-(methylamino)-1,3,4-thiadiazol-2-yl]methanone.
What is the SMILES notation for 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-(methylamino)-1,3,4-thiadiazol-2-yl]methanone?
The canonical SMILES for 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-(methylamino)-1,3,4-thiadiazol-2-yl]methanone is CNc1nnc(C(=O)N2CCn3ccnc3C2)s1.
What is the InChIKey of 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-(methylamino)-1,3,4-thiadiazol-2-yl]methanone?
The InChIKey is TWSRZCKZRPFMLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N6OS/c1-11-10-14-13-8(18-10)9(17)16-5-4-15-3-2-12-7(15)6-16/h2-3H,4-6H2,1H3,(H,11,14).
What are the key properties of 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-(methylamino)-1,3,4-thiadiazol-2-yl]methanone?
6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-(methylamino)-1,3,4-thiadiazol-2-yl]methanone has a molecular weight of 264.31 g/mol, XLogP of 0.43, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[5-(methylamino)-1,3,4-thiadiazol-2-yl]methanone is sourced from PubChem (CID 80616411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).