methyl 4-chloro-6-(2-methoxyphenyl)pyridine-2-carboxylate

C14H12ClNO3 — CID 12784965

IUPACmethyl 4-chloro-6-(2-methoxyphenyl)pyridine-2-carboxylate
SMILESCOC(=O)c1cc(Cl)cc(-c2ccccc2OC)n1
InChIInChI=1S/C14H12ClNO3/c1-18-13-6-4-3-5-10(13)11-7-9(15)8-12(16-11)14(17)19-2/h3-8H,1-2H3
InChIKeyWILGYGHCSSWBFC-UHFFFAOYSA-N
MW277.71 g/mol
LogP3.20
Rot. Bonds3

About methyl 4-chloro-6-(2-methoxyphenyl)pyridine-2-carboxylate

methyl 4-chloro-6-(2-methoxyphenyl)pyridine-2-carboxylate (PubChem CID 12784965) has the molecular formula C14H12ClNO3 and a molecular weight of 277.71 g/mol. Its IUPAC name is methyl 4-chloro-6-(2-methoxyphenyl)pyridine-2-carboxylate.

Molecular Properties

Compound Namemethyl 4-chloro-6-(2-methoxyphenyl)pyridine-2-carboxylate
PubChem CID12784965
Molecular FormulaC14H12ClNO3
Molecular Weight277.71 g/mol
Exact Mass277.05
IUPAC Namemethyl 4-chloro-6-(2-methoxyphenyl)pyridine-2-carboxylate
SMILESCOC(=O)c1cc(Cl)cc(-c2ccccc2OC)n1
InChIInChI=1S/C14H12ClNO3/c1-18-13-6-4-3-5-10(13)11-7-9(15)8-12(16-11)14(17)19-2/h3-8H,1-2H3
InChIKeyWILGYGHCSSWBFC-UHFFFAOYSA-N
XLogP3.20
TPSA48.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.71
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 4-chloro-6-phenylpyridine-2-carboxylate
CID 12784958
tert-butyl N-[4-chloro-6-(2-methoxyphenyl)-2-pyridinyl]carbamate
CID 91422151
4-chloro-6-(2-methoxyphenyl)pyridin-2-amine;2,2,2-trifluoroacetic acid
CID 68953049
tert-butyl-[4-chloro-6-(2-methoxyphenyl)-2-pyridinyl]carbamic acid
CID 68955432
2-amino-6-(2-methoxyphenyl)pyrimidine-4-carboxylic acid
CID 28799604
methyl 3-(6-carbamoyl-4-chloro-2-pyridinyl)pyridine-2-carboxylate
CID 71245215
4-chloro-6-(2-methylphenyl)pyridine-2-carboxylic acid
CID 12784962
6-(2-methoxyphenyl)-2-methylpyrimidine-4-carboxamide
CID 67546414
methyl 5-(2-methoxyphenyl)-1-methylpyrazole-3-carboxylate
CID 62267837
carbon dioxide;methyl 4-chloro-6-methylpyridine-2-carboxylate
CID 158534965
methyl 2-(2-methoxyphenyl)imidazo[1,2-a]pyridine-7-carboxylate
CID 117135447
methyl 8-chloro-4-methoxyquinoline-2-carboxylate
CID 53419812

Frequently Asked Questions

What is the IUPAC name of methyl 4-chloro-6-(2-methoxyphenyl)pyridine-2-carboxylate?
The IUPAC name of methyl 4-chloro-6-(2-methoxyphenyl)pyridine-2-carboxylate (CID 12784965) is methyl 4-chloro-6-(2-methoxyphenyl)pyridine-2-carboxylate.
What is the SMILES notation for methyl 4-chloro-6-(2-methoxyphenyl)pyridine-2-carboxylate?
The canonical SMILES for methyl 4-chloro-6-(2-methoxyphenyl)pyridine-2-carboxylate is COC(=O)c1cc(Cl)cc(-c2ccccc2OC)n1.
What is the InChIKey of methyl 4-chloro-6-(2-methoxyphenyl)pyridine-2-carboxylate?
The InChIKey is WILGYGHCSSWBFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClNO3/c1-18-13-6-4-3-5-10(13)11-7-9(15)8-12(16-11)14(17)19-2/h3-8H,1-2H3.
What are the key properties of methyl 4-chloro-6-(2-methoxyphenyl)pyridine-2-carboxylate?
methyl 4-chloro-6-(2-methoxyphenyl)pyridine-2-carboxylate has a molecular weight of 277.71 g/mol, XLogP of 3.20, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-chloro-6-(2-methoxyphenyl)pyridine-2-carboxylate is sourced from PubChem (CID 12784965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).