methyl 2-ethyl-6-(3-methoxyphenyl)pyridine-3-carboxylate

C16H17NO3 — CID 134280348

IUPACmethyl 2-ethyl-6-(3-methoxyphenyl)pyridine-3-carboxylate
SMILESCCc1nc(-c2cccc(OC)c2)ccc1C(=O)OC
InChIInChI=1S/C16H17NO3/c1-4-14-13(16(18)20-3)8-9-15(17-14)11-6-5-7-12(10-11)19-2/h5-10H,4H2,1-3H3
InChIKeyFZFZIGNRVXBNKV-UHFFFAOYSA-N
MW271.32 g/mol
LogP3.11
Rot. Bonds4

About methyl 2-ethyl-6-(3-methoxyphenyl)pyridine-3-carboxylate

methyl 2-ethyl-6-(3-methoxyphenyl)pyridine-3-carboxylate (PubChem CID 134280348) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is methyl 2-ethyl-6-(3-methoxyphenyl)pyridine-3-carboxylate.

Molecular Properties

Compound Namemethyl 2-ethyl-6-(3-methoxyphenyl)pyridine-3-carboxylate
PubChem CID134280348
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC Namemethyl 2-ethyl-6-(3-methoxyphenyl)pyridine-3-carboxylate
SMILESCCc1nc(-c2cccc(OC)c2)ccc1C(=O)OC
InChIInChI=1S/C16H17NO3/c1-4-14-13(16(18)20-3)8-9-15(17-14)11-6-5-7-12(10-11)19-2/h5-10H,4H2,1-3H3
InChIKeyFZFZIGNRVXBNKV-UHFFFAOYSA-N
XLogP3.11
TPSA48.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 6-(3-bromophenyl)-2-ethylpyridine-3-carboxylate
CID 134280333
ethyl 2-ethyl-6-(3-methylphenyl)pyridine-3-carboxylate
CID 116532844
methyl 1-ethyl-6-(3-methoxyphenyl)-3-methylpyrazolo[5,4-b]pyridine-4-carboxylate
CID 19585703
methyl 2-ethyl-6-phenoxypyridine-3-carboxylate
CID 134204658
methyl 6-(3-methoxyphenyl)pyrazine-2-carboxylate
CID 167450731
ethyl 8-amino-2-(3-methoxyphenyl)-1,7-naphthyridine-5-carboxylate
CID 71680298
2-ethyl-6-phenylpyridine-3-carboxylic acid
CID 91810897
2-(cyclopropylmethylamino)-6-(3-methoxyphenyl)-N-methylpyridine-3-carboxamide
CID 126475287
1-[6-(3-ethoxyphenyl)-2-methyl-3-pyridinyl]ethanone
CID 82453012
6-ethyl-2-(3-methoxyphenyl)quinoline-4-carbonyl chloride
CID 46779788
methyl 4-chloro-2-(3-methoxyphenyl)pyrimidine-5-carboxylate
CID 82169042
ethyl 5-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidine-3-carboxylate
CID 131986746

Frequently Asked Questions

What is the IUPAC name of methyl 2-ethyl-6-(3-methoxyphenyl)pyridine-3-carboxylate?
The IUPAC name of methyl 2-ethyl-6-(3-methoxyphenyl)pyridine-3-carboxylate (CID 134280348) is methyl 2-ethyl-6-(3-methoxyphenyl)pyridine-3-carboxylate.
What is the SMILES notation for methyl 2-ethyl-6-(3-methoxyphenyl)pyridine-3-carboxylate?
The canonical SMILES for methyl 2-ethyl-6-(3-methoxyphenyl)pyridine-3-carboxylate is CCc1nc(-c2cccc(OC)c2)ccc1C(=O)OC.
What is the InChIKey of methyl 2-ethyl-6-(3-methoxyphenyl)pyridine-3-carboxylate?
The InChIKey is FZFZIGNRVXBNKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c1-4-14-13(16(18)20-3)8-9-15(17-14)11-6-5-7-12(10-11)19-2/h5-10H,4H2,1-3H3.
What are the key properties of methyl 2-ethyl-6-(3-methoxyphenyl)pyridine-3-carboxylate?
methyl 2-ethyl-6-(3-methoxyphenyl)pyridine-3-carboxylate has a molecular weight of 271.32 g/mol, XLogP of 3.11, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-ethyl-6-(3-methoxyphenyl)pyridine-3-carboxylate is sourced from PubChem (CID 134280348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).