2-methyl-3-phenylmethoxyquinoline

C17H15NO — CID 3841340

IUPAC2-methyl-3-phenylmethoxyquinoline
SMILESCc1nc2ccccc2cc1OCc1ccccc1
InChIInChI=1S/C17H15NO/c1-13-17(19-12-14-7-3-2-4-8-14)11-15-9-5-6-10-16(15)18-13/h2-11H,12H2,1H3
InChIKeyQCEYXLPBTZCAKG-UHFFFAOYSA-N
MW249.31 g/mol
LogP4.12
Rot. Bonds3

About 2-methyl-3-phenylmethoxyquinoline

2-methyl-3-phenylmethoxyquinoline (PubChem CID 3841340) has the molecular formula C17H15NO and a molecular weight of 249.31 g/mol. Its IUPAC name is 2-methyl-3-phenylmethoxyquinoline.

Molecular Properties

Compound Name2-methyl-3-phenylmethoxyquinoline
PubChem CID3841340
Molecular FormulaC17H15NO
Molecular Weight249.31 g/mol
Exact Mass249.12
IUPAC Name2-methyl-3-phenylmethoxyquinoline
SMILESCc1nc2ccccc2cc1OCc1ccccc1
InChIInChI=1S/C17H15NO/c1-13-17(19-12-14-7-3-2-4-8-14)11-15-9-5-6-10-16(15)18-13/h2-11H,12H2,1H3
InChIKeyQCEYXLPBTZCAKG-UHFFFAOYSA-N
XLogP4.12
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 ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-phenylmethoxyquinoline?
The IUPAC name of 2-methyl-3-phenylmethoxyquinoline (CID 3841340) is 2-methyl-3-phenylmethoxyquinoline.
What is the SMILES notation for 2-methyl-3-phenylmethoxyquinoline?
The canonical SMILES for 2-methyl-3-phenylmethoxyquinoline is Cc1nc2ccccc2cc1OCc1ccccc1.
What is the InChIKey of 2-methyl-3-phenylmethoxyquinoline?
The InChIKey is QCEYXLPBTZCAKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO/c1-13-17(19-12-14-7-3-2-4-8-14)11-15-9-5-6-10-16(15)18-13/h2-11H,12H2,1H3.
What are the key properties of 2-methyl-3-phenylmethoxyquinoline?
2-methyl-3-phenylmethoxyquinoline has a molecular weight of 249.31 g/mol, XLogP of 4.12, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-phenylmethoxyquinoline is sourced from PubChem (CID 3841340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).