3-[(2-benzylphenoxy)methyl]pyridine

C19H17NO — CID 112814185

IUPAC3-[(2-benzylphenoxy)methyl]pyridine
SMILESc1ccc(Cc2ccccc2OCc2cccnc2)cc1
InChIInChI=1S/C19H17NO/c1-2-7-16(8-3-1)13-18-10-4-5-11-19(18)21-15-17-9-6-12-20-14-17/h1-12,14H,13,15H2
InChIKeyQFBYRAAFATXYBQ-UHFFFAOYSA-N
MW275.35 g/mol
LogP4.25
Rot. Bonds5

About 3-[(2-benzylphenoxy)methyl]pyridine

3-[(2-benzylphenoxy)methyl]pyridine (PubChem CID 112814185) has the molecular formula C19H17NO and a molecular weight of 275.35 g/mol. Its IUPAC name is 3-[(2-benzylphenoxy)methyl]pyridine.

Molecular Properties

Compound Name3-[(2-benzylphenoxy)methyl]pyridine
PubChem CID112814185
Molecular FormulaC19H17NO
Molecular Weight275.35 g/mol
Exact Mass275.13
IUPAC Name3-[(2-benzylphenoxy)methyl]pyridine
SMILESc1ccc(Cc2ccccc2OCc2cccnc2)cc1
InChIInChI=1S/C19H17NO/c1-2-7-16(8-3-1)13-18-10-4-5-11-19(18)21-15-17-9-6-12-20-14-17/h1-12,14H,13,15H2
InChIKeyQFBYRAAFATXYBQ-UHFFFAOYSA-N
XLogP4.25
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-[(2-benzylphenoxy)methyl]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[[2-(pyridin-3-ylmethoxy)phenoxy]methyl]pyridine
CID 102197893
2-[[2-(pyridin-3-ylmethoxy)phenyl]methylamino]ethanol
CID 111421639
2-(pyridin-3-ylmethoxy)benzaldehyde
CID 6485567
3-(phenoxymethyl)pyridine;hydrochloride
CID 157085776
3-[[2-(pyridin-3-ylmethoxy)phenyl]methylamino]propan-1-ol
CID 110929258
3-[[2-[2-(3-methoxyphenyl)ethyl]phenoxy]methyl]pyridine
CID 11973926
[2-(pyridin-3-ylmethoxy)phenyl]boronic acid
CID 43145276
3-[[4-chloro-2-(chloromethyl)phenoxy]methyl]pyridine
CID 39869127
2-ethyl-2-[[[2-(pyridin-3-ylmethoxy)phenyl]methylamino]methyl]butanoic acid
CID 122129096
3-[[4-(pyridin-3-ylmethoxy)phenoxy]methyl]pyridine
CID 91147542
3-methyl-1-[[2-(pyridin-3-ylmethoxy)phenyl]methylamino]butan-2-ol
CID 111422039
(1S)-1-(5-methyl-1,3-oxazol-2-yl)-N-[[2-(pyridin-3-ylmethoxy)phenyl]methyl]ethanamine
CID 97347457

Frequently Asked Questions

What is the IUPAC name of 3-[(2-benzylphenoxy)methyl]pyridine?
The IUPAC name of 3-[(2-benzylphenoxy)methyl]pyridine (CID 112814185) is 3-[(2-benzylphenoxy)methyl]pyridine.
What is the SMILES notation for 3-[(2-benzylphenoxy)methyl]pyridine?
The canonical SMILES for 3-[(2-benzylphenoxy)methyl]pyridine is c1ccc(Cc2ccccc2OCc2cccnc2)cc1.
What is the InChIKey of 3-[(2-benzylphenoxy)methyl]pyridine?
The InChIKey is QFBYRAAFATXYBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO/c1-2-7-16(8-3-1)13-18-10-4-5-11-19(18)21-15-17-9-6-12-20-14-17/h1-12,14H,13,15H2.
What are the key properties of 3-[(2-benzylphenoxy)methyl]pyridine?
3-[(2-benzylphenoxy)methyl]pyridine has a molecular weight of 275.35 g/mol, XLogP of 4.25, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-benzylphenoxy)methyl]pyridine is sourced from PubChem (CID 112814185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).