(4-methylphenyl)-(5-methylpyrazin-2-yl)methanol

C13H14N2O — CID 105078243

IUPAC(4-methylphenyl)-(5-methylpyrazin-2-yl)methanol
SMILESCc1ccc(C(O)c2cnc(C)cn2)cc1
InChIInChI=1S/C13H14N2O/c1-9-3-5-11(6-4-9)13(16)12-8-14-10(2)7-15-12/h3-8,13,16H,1-2H3
InChIKeyKBZXPNIMOQONDL-UHFFFAOYSA-N
MW214.27 g/mol
LogP2.18
Rot. Bonds2

About (4-methylphenyl)-(5-methylpyrazin-2-yl)methanol

(4-methylphenyl)-(5-methylpyrazin-2-yl)methanol (PubChem CID 105078243) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is (4-methylphenyl)-(5-methylpyrazin-2-yl)methanol.

Molecular Properties

Compound Name(4-methylphenyl)-(5-methylpyrazin-2-yl)methanol
PubChem CID105078243
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name(4-methylphenyl)-(5-methylpyrazin-2-yl)methanol
SMILESCc1ccc(C(O)c2cnc(C)cn2)cc1
InChIInChI=1S/C13H14N2O/c1-9-3-5-11(6-4-9)13(16)12-8-14-10(2)7-15-12/h3-8,13,16H,1-2H3
InChIKeyKBZXPNIMOQONDL-UHFFFAOYSA-N
XLogP2.18
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-ethylphenyl)-(5-methylpyrazin-2-yl)methanol
CID 105084396
(5-methylpyrazin-2-yl)-quinolin-3-ylmethanol
CID 105079360
(2-methoxy-4,6-dimethylphenyl)-(5-methylpyrazin-2-yl)methanol
CID 106682549
(5-methylpyrazin-2-yl)-(1,2-thiazol-5-yl)methanol
CID 131036675
(4-methylphenyl)-[4-(4-methylphenyl)phenyl]methanol
CID 143325793
(2,6-difluoro-3-methylphenyl)-(5-methylpyrazin-2-yl)methanol
CID 105121731
(4-cyclopropyloxyphenyl)-(5-methyl-2-pyridinyl)methanol
CID 114518682
(2,4-difluorophenyl)-(5-methylpyrazin-2-yl)methanol
CID 105094711
(4-methylphenyl)-pyrimidin-5-ylmethanol
CID 62491341
cyclohepten-1-yl-(5-methylpyrazin-2-yl)methanol
CID 106657819
(4-methylphenyl)-pyridin-4-ylmethanol
CID 3383504
(5-methylpyrazin-2-yl)-quinolin-5-ylmethanol
CID 105118175

Frequently Asked Questions

What is the IUPAC name of (4-methylphenyl)-(5-methylpyrazin-2-yl)methanol?
The IUPAC name of (4-methylphenyl)-(5-methylpyrazin-2-yl)methanol (CID 105078243) is (4-methylphenyl)-(5-methylpyrazin-2-yl)methanol.
What is the SMILES notation for (4-methylphenyl)-(5-methylpyrazin-2-yl)methanol?
The canonical SMILES for (4-methylphenyl)-(5-methylpyrazin-2-yl)methanol is Cc1ccc(C(O)c2cnc(C)cn2)cc1.
What is the InChIKey of (4-methylphenyl)-(5-methylpyrazin-2-yl)methanol?
The InChIKey is KBZXPNIMOQONDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c1-9-3-5-11(6-4-9)13(16)12-8-14-10(2)7-15-12/h3-8,13,16H,1-2H3.
What are the key properties of (4-methylphenyl)-(5-methylpyrazin-2-yl)methanol?
(4-methylphenyl)-(5-methylpyrazin-2-yl)methanol has a molecular weight of 214.27 g/mol, XLogP of 2.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylphenyl)-(5-methylpyrazin-2-yl)methanol is sourced from PubChem (CID 105078243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).