2-(1-methylimidazol-2-yl)-1-pyrazin-2-ylethanol

C10H12N4O — CID 79752608

IUPAC2-(1-methylimidazol-2-yl)-1-pyrazin-2-ylethanol
SMILESCn1ccnc1CC(O)c1cnccn1
InChIInChI=1S/C10H12N4O/c1-14-5-4-13-10(14)6-9(15)8-7-11-2-3-12-8/h2-5,7,9,15H,6H2,1H3
InChIKeyKMKRPMLVUODMNK-UHFFFAOYSA-N
MW204.23 g/mol
LogP0.49
Rot. Bonds3

About 2-(1-methylimidazol-2-yl)-1-pyrazin-2-ylethanol

2-(1-methylimidazol-2-yl)-1-pyrazin-2-ylethanol (PubChem CID 79752608) has the molecular formula C10H12N4O and a molecular weight of 204.23 g/mol. Its IUPAC name is 2-(1-methylimidazol-2-yl)-1-pyrazin-2-ylethanol.

Molecular Properties

Compound Name2-(1-methylimidazol-2-yl)-1-pyrazin-2-ylethanol
PubChem CID79752608
Molecular FormulaC10H12N4O
Molecular Weight204.23 g/mol
Exact Mass204.10
IUPAC Name2-(1-methylimidazol-2-yl)-1-pyrazin-2-ylethanol
SMILESCn1ccnc1CC(O)c1cnccn1
InChIInChI=1S/C10H12N4O/c1-14-5-4-13-10(14)6-9(15)8-7-11-2-3-12-8/h2-5,7,9,15H,6H2,1H3
InChIKeyKMKRPMLVUODMNK-UHFFFAOYSA-N
XLogP0.49
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylimidazol-2-yl)-1-pyrazin-2-ylethanol?
The IUPAC name of 2-(1-methylimidazol-2-yl)-1-pyrazin-2-ylethanol (CID 79752608) is 2-(1-methylimidazol-2-yl)-1-pyrazin-2-ylethanol.
What is the SMILES notation for 2-(1-methylimidazol-2-yl)-1-pyrazin-2-ylethanol?
The canonical SMILES for 2-(1-methylimidazol-2-yl)-1-pyrazin-2-ylethanol is Cn1ccnc1CC(O)c1cnccn1.
What is the InChIKey of 2-(1-methylimidazol-2-yl)-1-pyrazin-2-ylethanol?
The InChIKey is KMKRPMLVUODMNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O/c1-14-5-4-13-10(14)6-9(15)8-7-11-2-3-12-8/h2-5,7,9,15H,6H2,1H3.
What are the key properties of 2-(1-methylimidazol-2-yl)-1-pyrazin-2-ylethanol?
2-(1-methylimidazol-2-yl)-1-pyrazin-2-ylethanol has a molecular weight of 204.23 g/mol, XLogP of 0.49, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylimidazol-2-yl)-1-pyrazin-2-ylethanol is sourced from PubChem (CID 79752608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).