[3-[(6-methylpyrazin-2-yl)methyl]phenyl]methanol

C13H14N2O — CID 171354448

IUPAC[3-[(6-methylpyrazin-2-yl)methyl]phenyl]methanol
SMILESCc1cncc(Cc2cccc(CO)c2)n1
InChIInChI=1S/C13H14N2O/c1-10-7-14-8-13(15-10)6-11-3-2-4-12(5-11)9-16/h2-5,7-8,16H,6,9H2,1H3
InChIKeyLZZHXWJCZMLONQ-UHFFFAOYSA-N
MW214.27 g/mol
LogP1.87
Rot. Bonds3

About [3-[(6-methylpyrazin-2-yl)methyl]phenyl]methanol

[3-[(6-methylpyrazin-2-yl)methyl]phenyl]methanol (PubChem CID 171354448) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is [3-[(6-methylpyrazin-2-yl)methyl]phenyl]methanol.

Molecular Properties

Compound Name[3-[(6-methylpyrazin-2-yl)methyl]phenyl]methanol
PubChem CID171354448
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name[3-[(6-methylpyrazin-2-yl)methyl]phenyl]methanol
SMILESCc1cncc(Cc2cccc(CO)c2)n1
InChIInChI=1S/C13H14N2O/c1-10-7-14-8-13(15-10)6-11-3-2-4-12(5-11)9-16/h2-5,7-8,16H,6,9H2,1H3
InChIKeyLZZHXWJCZMLONQ-UHFFFAOYSA-N
XLogP1.87
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [3-[(6-methylpyrazin-2-yl)methyl]phenyl]methanol?
The IUPAC name of [3-[(6-methylpyrazin-2-yl)methyl]phenyl]methanol (CID 171354448) is [3-[(6-methylpyrazin-2-yl)methyl]phenyl]methanol.
What is the SMILES notation for [3-[(6-methylpyrazin-2-yl)methyl]phenyl]methanol?
The canonical SMILES for [3-[(6-methylpyrazin-2-yl)methyl]phenyl]methanol is Cc1cncc(Cc2cccc(CO)c2)n1.
What is the InChIKey of [3-[(6-methylpyrazin-2-yl)methyl]phenyl]methanol?
The InChIKey is LZZHXWJCZMLONQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c1-10-7-14-8-13(15-10)6-11-3-2-4-12(5-11)9-16/h2-5,7-8,16H,6,9H2,1H3.
What are the key properties of [3-[(6-methylpyrazin-2-yl)methyl]phenyl]methanol?
[3-[(6-methylpyrazin-2-yl)methyl]phenyl]methanol has a molecular weight of 214.27 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(6-methylpyrazin-2-yl)methyl]phenyl]methanol is sourced from PubChem (CID 171354448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).