6-[(3-methoxyphenyl)methyl]quinoline

C17H15NO — CID 172878073

IUPAC6-[(3-methoxyphenyl)methyl]quinoline
SMILESCOc1cccc(Cc2ccc3ncccc3c2)c1
InChIInChI=1S/C17H15NO/c1-19-16-6-2-4-13(12-16)10-14-7-8-17-15(11-14)5-3-9-18-17/h2-9,11-12H,10H2,1H3
InChIKeyYZEMKNPXPZOJGW-UHFFFAOYSA-N
MW249.31 g/mol
LogP3.83
Rot. Bonds3

About 6-[(3-methoxyphenyl)methyl]quinoline

6-[(3-methoxyphenyl)methyl]quinoline (PubChem CID 172878073) has the molecular formula C17H15NO and a molecular weight of 249.31 g/mol. Its IUPAC name is 6-[(3-methoxyphenyl)methyl]quinoline.

Molecular Properties

Compound Name6-[(3-methoxyphenyl)methyl]quinoline
PubChem CID172878073
Molecular FormulaC17H15NO
Molecular Weight249.31 g/mol
Exact Mass249.12
IUPAC Name6-[(3-methoxyphenyl)methyl]quinoline
SMILESCOc1cccc(Cc2ccc3ncccc3c2)c1
InChIInChI=1S/C17H15NO/c1-19-16-6-2-4-13(12-16)10-14-7-8-17-15(11-14)5-3-9-18-17/h2-9,11-12H,10H2,1H3
InChIKeyYZEMKNPXPZOJGW-UHFFFAOYSA-N
XLogP3.83
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3-methoxyphenyl)methyl]-4-methyl-N-(quinolin-6-ylmethyl)-1,3-oxazol-2-amine
CID 167466011
ethene;6-methoxyquinoline
CID 174599262
4-[(dimethylamino)methyl]-N-[(3-methoxyphenyl)methyl]-N-(quinolin-7-ylmethyl)aniline
CID 167466317
2,5-bis[(3-methoxyphenyl)methyl]pyridine
CID 91067305
N-[(3,5-dimethoxyphenyl)methyl]quinolin-6-amine
CID 165347661
ethane;ethylbenzene;6-ethylquinoline
CID 143817758
3-tert-butyl-2-[(3-methoxyphenyl)methyl]imidazo[4,5-b]pyridine
CID 117165077
3-bromo-5-methoxy-N-(quinolin-6-ylmethyl)aniline
CID 82860690
6-(3-methoxyprop-2-enyl)quinoline
CID 169099761
3-methoxybenzoic acid;quinoline
CID 67785482
6-[[5-(3-methoxyphenyl)triazolo[4,5-b]pyrazin-3-yl]methyl]quinoline
CID 24851840
3-(quinolin-6-ylmethyl)pyridin-2-amine
CID 81223845

Frequently Asked Questions

What is the IUPAC name of 6-[(3-methoxyphenyl)methyl]quinoline?
The IUPAC name of 6-[(3-methoxyphenyl)methyl]quinoline (CID 172878073) is 6-[(3-methoxyphenyl)methyl]quinoline.
What is the SMILES notation for 6-[(3-methoxyphenyl)methyl]quinoline?
The canonical SMILES for 6-[(3-methoxyphenyl)methyl]quinoline is COc1cccc(Cc2ccc3ncccc3c2)c1.
What is the InChIKey of 6-[(3-methoxyphenyl)methyl]quinoline?
The InChIKey is YZEMKNPXPZOJGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO/c1-19-16-6-2-4-13(12-16)10-14-7-8-17-15(11-14)5-3-9-18-17/h2-9,11-12H,10H2,1H3.
What are the key properties of 6-[(3-methoxyphenyl)methyl]quinoline?
6-[(3-methoxyphenyl)methyl]quinoline has a molecular weight of 249.31 g/mol, XLogP of 3.83, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3-methoxyphenyl)methyl]quinoline is sourced from PubChem (CID 172878073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).