7-[(5-methyl-1H-pyrazol-4-yl)sulfonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine

C10H13N5O2S — CID 63018949

IUPAC7-[(5-methyl-1H-pyrazol-4-yl)sulfonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
SMILESCc1[nH]ncc1S(=O)(=O)N1CCn2ccnc2C1
InChIInChI=1S/C10H13N5O2S/c1-8-9(6-12-13-8)18(16,17)15-5-4-14-3-2-11-10(14)7-15/h2-3,6H,4-5,7H2,1H3,(H,12,13)
InChIKeyOCENOSQHVPJMJI-UHFFFAOYSA-N
MW267.31 g/mol
LogP0.12
Rot. Bonds2

About 7-[(5-methyl-1H-pyrazol-4-yl)sulfonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine

7-[(5-methyl-1H-pyrazol-4-yl)sulfonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine (PubChem CID 63018949) has the molecular formula C10H13N5O2S and a molecular weight of 267.31 g/mol. Its IUPAC name is 7-[(5-methyl-1H-pyrazol-4-yl)sulfonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name7-[(5-methyl-1H-pyrazol-4-yl)sulfonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
PubChem CID63018949
Molecular FormulaC10H13N5O2S
Molecular Weight267.31 g/mol
Exact Mass267.08
IUPAC Name7-[(5-methyl-1H-pyrazol-4-yl)sulfonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
SMILESCc1[nH]ncc1S(=O)(=O)N1CCn2ccnc2C1
InChIInChI=1S/C10H13N5O2S/c1-8-9(6-12-13-8)18(16,17)15-5-4-14-3-2-11-10(14)7-15/h2-3,6H,4-5,7H2,1H3,(H,12,13)
InChIKeyOCENOSQHVPJMJI-UHFFFAOYSA-N
XLogP0.12
TPSA83.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.31
LogP ≤ 50.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-[(5-methyl-1H-pyrazol-4-yl)sulfonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The IUPAC name of 7-[(5-methyl-1H-pyrazol-4-yl)sulfonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine (CID 63018949) is 7-[(5-methyl-1H-pyrazol-4-yl)sulfonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine.
What is the SMILES notation for 7-[(5-methyl-1H-pyrazol-4-yl)sulfonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The canonical SMILES for 7-[(5-methyl-1H-pyrazol-4-yl)sulfonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine is Cc1[nH]ncc1S(=O)(=O)N1CCn2ccnc2C1.
What is the InChIKey of 7-[(5-methyl-1H-pyrazol-4-yl)sulfonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The InChIKey is OCENOSQHVPJMJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O2S/c1-8-9(6-12-13-8)18(16,17)15-5-4-14-3-2-11-10(14)7-15/h2-3,6H,4-5,7H2,1H3,(H,12,13).
What are the key properties of 7-[(5-methyl-1H-pyrazol-4-yl)sulfonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
7-[(5-methyl-1H-pyrazol-4-yl)sulfonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine has a molecular weight of 267.31 g/mol, XLogP of 0.12, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(5-methyl-1H-pyrazol-4-yl)sulfonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine is sourced from PubChem (CID 63018949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).