3-benzyl-5-(4-methoxyphenyl)-2-methylpyrazine

C19H18N2O — CID 70899886

IUPAC3-benzyl-5-(4-methoxyphenyl)-2-methylpyrazine
SMILESCOc1ccc(-c2cnc(C)c(Cc3ccccc3)n2)cc1
InChIInChI=1S/C19H18N2O/c1-14-18(12-15-6-4-3-5-7-15)21-19(13-20-14)16-8-10-17(22-2)11-9-16/h3-11,13H,12H2,1-2H3
InChIKeyDNZHNBGEKAFGIF-UHFFFAOYSA-N
MW290.37 g/mol
LogP4.05
Rot. Bonds4

About 3-benzyl-5-(4-methoxyphenyl)-2-methylpyrazine

3-benzyl-5-(4-methoxyphenyl)-2-methylpyrazine (PubChem CID 70899886) has the molecular formula C19H18N2O and a molecular weight of 290.37 g/mol. Its IUPAC name is 3-benzyl-5-(4-methoxyphenyl)-2-methylpyrazine.

Molecular Properties

Compound Name3-benzyl-5-(4-methoxyphenyl)-2-methylpyrazine
PubChem CID70899886
Molecular FormulaC19H18N2O
Molecular Weight290.37 g/mol
Exact Mass290.14
IUPAC Name3-benzyl-5-(4-methoxyphenyl)-2-methylpyrazine
SMILESCOc1ccc(-c2cnc(C)c(Cc3ccccc3)n2)cc1
InChIInChI=1S/C19H18N2O/c1-14-18(12-15-6-4-3-5-7-15)21-19(13-20-14)16-8-10-17(22-2)11-9-16/h3-11,13H,12H2,1-2H3
InChIKeyDNZHNBGEKAFGIF-UHFFFAOYSA-N
XLogP4.05
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-benzyl-5-(4-methoxyphenyl)pyrazin-2-amine;ethane
CID 153387650
3-benzyl-5-(4-propan-2-yloxyphenyl)pyrazin-2-amine
CID 58567148
3-benzyl-5-[4-(2-trimethylsilylethoxy)phenyl]pyrazin-2-amine
CID 155887577
N-[3-benzyl-5-(4-methylphenyl)pyrazin-2-yl]-2-(4-methoxyphenyl)acetamide;dichloromethane;tribromoborane
CID 123158666
3-benzyl-5-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]pyrazin-2-amine
CID 11486146
4-[4-(5-amino-6-benzylpyrazin-2-yl)phenoxy]butanoic acid
CID 174458677
2-methoxy-3-methyl-5-phenylpyrazine
CID 13123634
2,5-bis(4-benzylphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazole
CID 166805666
N-[3-benzyl-5-(4-methoxyphenyl)pyrazin-2-yl]-N-methyl-2-[2,3,4,5-tetrafluoro-6-(2-methylprop-1-enyl)phenyl]acetamide
CID 143000294
methyl 2-[(3-benzyl-5-phenylpyrazin-2-yl)amino]prop-2-enoate
CID 130356647
1-benzyl-4-methoxybenzene;molecular nitrogen
CID 175140604
3-(4-methoxyphenyl)phenanthro[9,10-b]pyrazine
CID 58019529

Frequently Asked Questions

What is the IUPAC name of 3-benzyl-5-(4-methoxyphenyl)-2-methylpyrazine?
The IUPAC name of 3-benzyl-5-(4-methoxyphenyl)-2-methylpyrazine (CID 70899886) is 3-benzyl-5-(4-methoxyphenyl)-2-methylpyrazine.
What is the SMILES notation for 3-benzyl-5-(4-methoxyphenyl)-2-methylpyrazine?
The canonical SMILES for 3-benzyl-5-(4-methoxyphenyl)-2-methylpyrazine is COc1ccc(-c2cnc(C)c(Cc3ccccc3)n2)cc1.
What is the InChIKey of 3-benzyl-5-(4-methoxyphenyl)-2-methylpyrazine?
The InChIKey is DNZHNBGEKAFGIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O/c1-14-18(12-15-6-4-3-5-7-15)21-19(13-20-14)16-8-10-17(22-2)11-9-16/h3-11,13H,12H2,1-2H3.
What are the key properties of 3-benzyl-5-(4-methoxyphenyl)-2-methylpyrazine?
3-benzyl-5-(4-methoxyphenyl)-2-methylpyrazine has a molecular weight of 290.37 g/mol, XLogP of 4.05, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzyl-5-(4-methoxyphenyl)-2-methylpyrazine is sourced from PubChem (CID 70899886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).