4-chloro-3,5-dimethyl-2-phenylmethoxypyridine

C14H14ClNO — CID 139821187

IUPAC4-chloro-3,5-dimethyl-2-phenylmethoxypyridine
SMILESCc1cnc(OCc2ccccc2)c(C)c1Cl
InChIInChI=1S/C14H14ClNO/c1-10-8-16-14(11(2)13(10)15)17-9-12-6-4-3-5-7-12/h3-8H,9H2,1-2H3
InChIKeyMYHGYTSVMUYOOV-UHFFFAOYSA-N
MW247.73 g/mol
LogP3.93
Rot. Bonds3

About 4-chloro-3,5-dimethyl-2-phenylmethoxypyridine

4-chloro-3,5-dimethyl-2-phenylmethoxypyridine (PubChem CID 139821187) has the molecular formula C14H14ClNO and a molecular weight of 247.73 g/mol. Its IUPAC name is 4-chloro-3,5-dimethyl-2-phenylmethoxypyridine.

Molecular Properties

Compound Name4-chloro-3,5-dimethyl-2-phenylmethoxypyridine
PubChem CID139821187
Molecular FormulaC14H14ClNO
Molecular Weight247.73 g/mol
Exact Mass247.08
IUPAC Name4-chloro-3,5-dimethyl-2-phenylmethoxypyridine
SMILESCc1cnc(OCc2ccccc2)c(C)c1Cl
InChIInChI=1S/C14H14ClNO/c1-10-8-16-14(11(2)13(10)15)17-9-12-6-4-3-5-7-12/h3-8H,9H2,1-2H3
InChIKeyMYHGYTSVMUYOOV-UHFFFAOYSA-N
XLogP3.93
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.73
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,4-dimethyl-5-phenylmethoxypyridine
CID 70023630
4,5-dimethyl-6-phenylmethoxy-2-pyrazin-2-ylpyrimidine
CID 95922345
7-chloro-3-methyl-2-phenylmethoxy-1,8-naphthyridine
CID 21073267
(1R)-1-(5-methyl-6-phenylmethoxy-3-pyridinyl)propan-1-ol
CID 124501397
4-chloro-2-cyclopropyl-5-methyl-6-phenylmethoxypyrimidine
CID 80974375
4-(2,2-difluoropropoxy)-5-methyl-6-phenylmethoxypyrimidine
CID 159140025
2-methyl-5-phenylmethoxypyrimidine
CID 59993103
2-bromo-5-chloro-3-phenylmethoxypyrazine
CID 121218855
2-fluoro-3,5-dimethyl-6-phenylmethoxypyridine
CID 144823733
3-chloro-2-methyl-5-phenylmethoxypyridine
CID 67611027
1-chloro-3-methyl-2-phenylmethoxybenzene
CID 71366901
4-chloro-5-ethyl-6-phenylmethoxypyrimidine
CID 55230236

Frequently Asked Questions

What is the IUPAC name of 4-chloro-3,5-dimethyl-2-phenylmethoxypyridine?
The IUPAC name of 4-chloro-3,5-dimethyl-2-phenylmethoxypyridine (CID 139821187) is 4-chloro-3,5-dimethyl-2-phenylmethoxypyridine.
What is the SMILES notation for 4-chloro-3,5-dimethyl-2-phenylmethoxypyridine?
The canonical SMILES for 4-chloro-3,5-dimethyl-2-phenylmethoxypyridine is Cc1cnc(OCc2ccccc2)c(C)c1Cl.
What is the InChIKey of 4-chloro-3,5-dimethyl-2-phenylmethoxypyridine?
The InChIKey is MYHGYTSVMUYOOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClNO/c1-10-8-16-14(11(2)13(10)15)17-9-12-6-4-3-5-7-12/h3-8H,9H2,1-2H3.
What are the key properties of 4-chloro-3,5-dimethyl-2-phenylmethoxypyridine?
4-chloro-3,5-dimethyl-2-phenylmethoxypyridine has a molecular weight of 247.73 g/mol, XLogP of 3.93, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3,5-dimethyl-2-phenylmethoxypyridine is sourced from PubChem (CID 139821187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).