3-chloro-2-methyl-5-phenylmethoxypyridine

C13H12ClNO — CID 67611027

IUPAC3-chloro-2-methyl-5-phenylmethoxypyridine
SMILESCc1ncc(OCc2ccccc2)cc1Cl
InChIInChI=1S/C13H12ClNO/c1-10-13(14)7-12(8-15-10)16-9-11-5-3-2-4-6-11/h2-8H,9H2,1H3
InChIKeyYBSPBJYEQKNSNE-UHFFFAOYSA-N
MW233.70 g/mol
LogP3.62
Rot. Bonds3

About 3-chloro-2-methyl-5-phenylmethoxypyridine

3-chloro-2-methyl-5-phenylmethoxypyridine (PubChem CID 67611027) has the molecular formula C13H12ClNO and a molecular weight of 233.70 g/mol. Its IUPAC name is 3-chloro-2-methyl-5-phenylmethoxypyridine.

Molecular Properties

Compound Name3-chloro-2-methyl-5-phenylmethoxypyridine
PubChem CID67611027
Molecular FormulaC13H12ClNO
Molecular Weight233.70 g/mol
Exact Mass233.06
IUPAC Name3-chloro-2-methyl-5-phenylmethoxypyridine
SMILESCc1ncc(OCc2ccccc2)cc1Cl
InChIInChI=1S/C13H12ClNO/c1-10-13(14)7-12(8-15-10)16-9-11-5-3-2-4-6-11/h2-8H,9H2,1H3
InChIKeyYBSPBJYEQKNSNE-UHFFFAOYSA-N
XLogP3.62
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.70
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-3-chloro-5-phenylmethoxypyridine
CID 71711003
2-methyl-5-phenylmethoxypyrimidine
CID 59993103
3-chloro-2-methyl-5-(1-phenylmethoxyethyl)pyridine
CID 22958392
2-bromo-3-methyl-5-phenylmethoxypyridine
CID 171367579
1-[(2-chloro-4-phenylmethoxyphenyl)methyl]-2,5-dimethylimidazole
CID 57138416
5-phenylmethoxypyrimidin-2-amine
CID 20748397
2-iodo-5-phenylmethoxypyrimidine
CID 153056979
2-chloro-4-phenylmethoxy-1-propan-2-yloxybenzene
CID 50888763
3,4-dichloro-6-phenylmethoxyquinoline
CID 114759785
N'-(3-methyl-5-phenylmethoxy-2-pyridinyl)ethane-1,2-diamine
CID 129055748
1,3-bis[[3,5-bis[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]phenyl]methoxy]-5-methylbenzene
CID 102395902
2-phenyl-5-phenylmethoxypyrimidine
CID 151774114

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-methyl-5-phenylmethoxypyridine?
The IUPAC name of 3-chloro-2-methyl-5-phenylmethoxypyridine (CID 67611027) is 3-chloro-2-methyl-5-phenylmethoxypyridine.
What is the SMILES notation for 3-chloro-2-methyl-5-phenylmethoxypyridine?
The canonical SMILES for 3-chloro-2-methyl-5-phenylmethoxypyridine is Cc1ncc(OCc2ccccc2)cc1Cl.
What is the InChIKey of 3-chloro-2-methyl-5-phenylmethoxypyridine?
The InChIKey is YBSPBJYEQKNSNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClNO/c1-10-13(14)7-12(8-15-10)16-9-11-5-3-2-4-6-11/h2-8H,9H2,1H3.
What are the key properties of 3-chloro-2-methyl-5-phenylmethoxypyridine?
3-chloro-2-methyl-5-phenylmethoxypyridine has a molecular weight of 233.70 g/mol, XLogP of 3.62, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-methyl-5-phenylmethoxypyridine is sourced from PubChem (CID 67611027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).