2-[(4-methoxyphenyl)methyl]-4,5-dimethylpyridine

C15H17NO — CID 11172203

IUPAC2-[(4-methoxyphenyl)methyl]-4,5-dimethylpyridine
SMILESCOc1ccc(Cc2cc(C)c(C)cn2)cc1
InChIInChI=1S/C15H17NO/c1-11-8-14(16-10-12(11)2)9-13-4-6-15(17-3)7-5-13/h4-8,10H,9H2,1-3H3
InChIKeyOSNXHIUAYIVMIL-UHFFFAOYSA-N
MW227.31 g/mol
LogP3.30
Rot. Bonds3

About 2-[(4-methoxyphenyl)methyl]-4,5-dimethylpyridine

2-[(4-methoxyphenyl)methyl]-4,5-dimethylpyridine (PubChem CID 11172203) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is 2-[(4-methoxyphenyl)methyl]-4,5-dimethylpyridine.

Molecular Properties

Compound Name2-[(4-methoxyphenyl)methyl]-4,5-dimethylpyridine
PubChem CID11172203
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name2-[(4-methoxyphenyl)methyl]-4,5-dimethylpyridine
SMILESCOc1ccc(Cc2cc(C)c(C)cn2)cc1
InChIInChI=1S/C15H17NO/c1-11-8-14(16-10-12(11)2)9-13-4-6-15(17-3)7-5-13/h4-8,10H,9H2,1-3H3
InChIKeyOSNXHIUAYIVMIL-UHFFFAOYSA-N
XLogP3.30
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-methoxy-1-[(4-methoxyphenyl)methyl]-2-methylbenzene
CID 15654338
4-[[4-(4-methoxyphenoxy)phenyl]methyl]-1,2-dimethylbenzene
CID 58598667
2,9-bis[(4-methoxyphenyl)methyl]-1,10-phenanthroline
CID 67372925
4-iodo-2-[(4-methoxyphenyl)methoxy]-5-methylpyridine
CID 157251524
1-methoxy-3-[(4-methoxy-3-methylphenyl)methyl]-5-[(4-methoxyphenyl)methyl]benzene
CID 146175274
ethane;1-[(4-methoxyphenyl)methyl]-2,4-dimethylbenzene
CID 143200250
1-[2-[(4-methoxyphenyl)methyl]-4-methylpyrimidin-5-yl]ethanol
CID 62770507
2,5-bis[(3-methoxyphenyl)methyl]pyridine
CID 91067305
4-[(4-methoxyphenyl)methoxy]-2,6-dimethylbenzaldehyde
CID 89075943
2-N-[(4-methoxyphenyl)methyl]-5-methylpyridine-2,4-diamine
CID 83265796
CID 175604529
CID 175604529
2-[5-[(4-methoxyphenyl)methyl]-1H-pyrazol-3-yl]ethanol
CID 123143670

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methoxyphenyl)methyl]-4,5-dimethylpyridine?
The IUPAC name of 2-[(4-methoxyphenyl)methyl]-4,5-dimethylpyridine (CID 11172203) is 2-[(4-methoxyphenyl)methyl]-4,5-dimethylpyridine.
What is the SMILES notation for 2-[(4-methoxyphenyl)methyl]-4,5-dimethylpyridine?
The canonical SMILES for 2-[(4-methoxyphenyl)methyl]-4,5-dimethylpyridine is COc1ccc(Cc2cc(C)c(C)cn2)cc1.
What is the InChIKey of 2-[(4-methoxyphenyl)methyl]-4,5-dimethylpyridine?
The InChIKey is OSNXHIUAYIVMIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO/c1-11-8-14(16-10-12(11)2)9-13-4-6-15(17-3)7-5-13/h4-8,10H,9H2,1-3H3.
What are the key properties of 2-[(4-methoxyphenyl)methyl]-4,5-dimethylpyridine?
2-[(4-methoxyphenyl)methyl]-4,5-dimethylpyridine has a molecular weight of 227.31 g/mol, XLogP of 3.30, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxyphenyl)methyl]-4,5-dimethylpyridine is sourced from PubChem (CID 11172203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).