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

C9H11N5O2S — CID 55145010

IUPAC7-(1H-pyrazol-4-ylsulfonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
SMILESO=S(=O)(c1cn[nH]c1)N1CCn2ccnc2C1
InChIInChI=1S/C9H11N5O2S/c15-17(16,8-5-11-12-6-8)14-4-3-13-2-1-10-9(13)7-14/h1-2,5-6H,3-4,7H2,(H,11,12)
InChIKeyDYEKNLRJIYDFPG-UHFFFAOYSA-N
MW253.29 g/mol
LogP-0.19
Rot. Bonds2

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

7-(1H-pyrazol-4-ylsulfonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine (PubChem CID 55145010) has the molecular formula C9H11N5O2S and a molecular weight of 253.29 g/mol. Its IUPAC name is 7-(1H-pyrazol-4-ylsulfonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name7-(1H-pyrazol-4-ylsulfonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
PubChem CID55145010
Molecular FormulaC9H11N5O2S
Molecular Weight253.29 g/mol
Exact Mass253.06
IUPAC Name7-(1H-pyrazol-4-ylsulfonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
SMILESO=S(=O)(c1cn[nH]c1)N1CCn2ccnc2C1
InChIInChI=1S/C9H11N5O2S/c15-17(16,8-5-11-12-6-8)14-4-3-13-2-1-10-9(13)7-14/h1-2,5-6H,3-4,7H2,(H,11,12)
InChIKeyDYEKNLRJIYDFPG-UHFFFAOYSA-N
XLogP-0.19
TPSA83.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.29
LogP ≤ 5-0.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-(1H-pyrazol-4-ylsulfonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The IUPAC name of 7-(1H-pyrazol-4-ylsulfonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine (CID 55145010) is 7-(1H-pyrazol-4-ylsulfonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine.
What is the SMILES notation for 7-(1H-pyrazol-4-ylsulfonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The canonical SMILES for 7-(1H-pyrazol-4-ylsulfonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine is O=S(=O)(c1cn[nH]c1)N1CCn2ccnc2C1.
What is the InChIKey of 7-(1H-pyrazol-4-ylsulfonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The InChIKey is DYEKNLRJIYDFPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5O2S/c15-17(16,8-5-11-12-6-8)14-4-3-13-2-1-10-9(13)7-14/h1-2,5-6H,3-4,7H2,(H,11,12).
What are the key properties of 7-(1H-pyrazol-4-ylsulfonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
7-(1H-pyrazol-4-ylsulfonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine has a molecular weight of 253.29 g/mol, XLogP of -0.19, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1H-pyrazol-4-ylsulfonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine is sourced from PubChem (CID 55145010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).