(3-methoxypyrazin-2-yl)-(4-propan-2-ylphenyl)methanol

C15H18N2O2 — CID 104514527

IUPAC(3-methoxypyrazin-2-yl)-(4-propan-2-ylphenyl)methanol
SMILESCOc1nccnc1C(O)c1ccc(C(C)C)cc1
InChIInChI=1S/C15H18N2O2/c1-10(2)11-4-6-12(7-5-11)14(18)13-15(19-3)17-9-8-16-13/h4-10,14,18H,1-3H3
InChIKeyOPIJSMPBRQEAOZ-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.69
Rot. Bonds4

About (3-methoxypyrazin-2-yl)-(4-propan-2-ylphenyl)methanol

(3-methoxypyrazin-2-yl)-(4-propan-2-ylphenyl)methanol (PubChem CID 104514527) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is (3-methoxypyrazin-2-yl)-(4-propan-2-ylphenyl)methanol.

Molecular Properties

Compound Name(3-methoxypyrazin-2-yl)-(4-propan-2-ylphenyl)methanol
PubChem CID104514527
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name(3-methoxypyrazin-2-yl)-(4-propan-2-ylphenyl)methanol
SMILESCOc1nccnc1C(O)c1ccc(C(C)C)cc1
InChIInChI=1S/C15H18N2O2/c1-10(2)11-4-6-12(7-5-11)14(18)13-15(19-3)17-9-8-16-13/h4-10,14,18H,1-3H3
InChIKeyOPIJSMPBRQEAOZ-UHFFFAOYSA-N
XLogP2.69
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 104514494
(4-butoxyphenyl)-(3-methoxypyrazin-2-yl)methanol
CID 105123968
[4-fluoro-3-(trifluoromethyl)phenyl]-(3-methoxypyrazin-2-yl)methanol
CID 104514714
(3-methoxypyrazin-2-yl)-(3-propoxyphenyl)methanol
CID 104514492
(2,5-dimethylphenyl)-(3-methoxypyrazin-2-yl)methanol
CID 104514541
(3-methoxypyrazin-2-yl)-(2H-triazol-4-yl)methanol
CID 104515213
(2-bromo-4-methylphenyl)-(3-methoxypyrazin-2-yl)methanol
CID 113421466
(3-bromo-2-fluorophenyl)-(3-methoxypyrazin-2-yl)methanol
CID 114020210
4-methoxy-1-(3-methoxypyrazin-2-yl)pentan-1-ol
CID 105123882
(1,5-dimethylpyrazol-4-yl)-(3-methoxypyrazin-2-yl)methanol
CID 113421458
(3-methoxy-4-methylphenyl)-(3-methoxypyrazin-2-yl)methanamine
CID 105031995
1-(3-methoxypyrazin-2-yl)-3,4,4-trimethylpentan-1-ol
CID 115831089

Frequently Asked Questions

What is the IUPAC name of (3-methoxypyrazin-2-yl)-(4-propan-2-ylphenyl)methanol?
The IUPAC name of (3-methoxypyrazin-2-yl)-(4-propan-2-ylphenyl)methanol (CID 104514527) is (3-methoxypyrazin-2-yl)-(4-propan-2-ylphenyl)methanol.
What is the SMILES notation for (3-methoxypyrazin-2-yl)-(4-propan-2-ylphenyl)methanol?
The canonical SMILES for (3-methoxypyrazin-2-yl)-(4-propan-2-ylphenyl)methanol is COc1nccnc1C(O)c1ccc(C(C)C)cc1.
What is the InChIKey of (3-methoxypyrazin-2-yl)-(4-propan-2-ylphenyl)methanol?
The InChIKey is OPIJSMPBRQEAOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-10(2)11-4-6-12(7-5-11)14(18)13-15(19-3)17-9-8-16-13/h4-10,14,18H,1-3H3.
What are the key properties of (3-methoxypyrazin-2-yl)-(4-propan-2-ylphenyl)methanol?
(3-methoxypyrazin-2-yl)-(4-propan-2-ylphenyl)methanol has a molecular weight of 258.32 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxypyrazin-2-yl)-(4-propan-2-ylphenyl)methanol is sourced from PubChem (CID 104514527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).