methyl 6-methoxy-3-phenylmethoxypyridine-2-carboxylate

C15H15NO4 — CID 22175139

IUPACmethyl 6-methoxy-3-phenylmethoxypyridine-2-carboxylate
SMILESCOC(=O)c1nc(OC)ccc1OCc1ccccc1
InChIInChI=1S/C15H15NO4/c1-18-13-9-8-12(14(16-13)15(17)19-2)20-10-11-6-4-3-5-7-11/h3-9H,10H2,1-2H3
InChIKeyLGOGLSSLIBDVGW-UHFFFAOYSA-N
MW273.29 g/mol
LogP2.46
Rot. Bonds5

About methyl 6-methoxy-3-phenylmethoxypyridine-2-carboxylate

methyl 6-methoxy-3-phenylmethoxypyridine-2-carboxylate (PubChem CID 22175139) has the molecular formula C15H15NO4 and a molecular weight of 273.29 g/mol. Its IUPAC name is methyl 6-methoxy-3-phenylmethoxypyridine-2-carboxylate.

Molecular Properties

Compound Namemethyl 6-methoxy-3-phenylmethoxypyridine-2-carboxylate
PubChem CID22175139
Molecular FormulaC15H15NO4
Molecular Weight273.29 g/mol
Exact Mass273.10
IUPAC Namemethyl 6-methoxy-3-phenylmethoxypyridine-2-carboxylate
SMILESCOC(=O)c1nc(OC)ccc1OCc1ccccc1
InChIInChI=1S/C15H15NO4/c1-18-13-9-8-12(14(16-13)15(17)19-2)20-10-11-6-4-3-5-7-11/h3-9H,10H2,1-2H3
InChIKeyLGOGLSSLIBDVGW-UHFFFAOYSA-N
XLogP2.46
TPSA57.65 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

Methyl 6-[3-(trifluoromethyl)phenoxy]-2-pyridinecarboxylate
CID 3314738
3-[6-(2-Carboxy-vinyl)-5-dodecyloxy-pyridin-2-ylmethoxy]-benzoic acid
CID 14977907
{[2-(Acetyloxy)benzoyl]oxy}methyl 6-[(Nitrooxy)methyl]pyridine-2-carboxylate
CID 25264572
2-Phenyl 6-propan-2-YL pyridine-2,6-dicarboxylate
CID 3492878
2-Ethyl 6-phenyl pyridine-2,6-dicarboxylate
CID 4032767
6-[[3-(1-Hydroxyhexyl)phenoxy]methyl]pyridine-2-carboxylic acid
CID 13560722
Methyl 6-[[3-(1-hydroxyhexyl)phenoxy]methyl]pyridine-2-carboxylate
CID 21280517
4H-Pyrano(3,2-b)pyridin-4-one, 2-phenyl-
CID 3047503
Pyridine-2,6-dicarboxylic acid di-p-tolyl ester
CID 864874
4-Acetoxy-1-phenyl-isoquinoline-3-carboxylic acid ethyl ester
CID 12424768
Methyl 6-[(2-formyl-4-methoxyphenoxy)methyl]pyridine-2-carboxylate
CID 139511659
Methyl 6-[(2-formyl-3-hydroxyphenoxy)methyl]-2-pyridinecarboxylate
CID 139513796

Frequently Asked Questions

What is the IUPAC name of methyl 6-methoxy-3-phenylmethoxypyridine-2-carboxylate?
The IUPAC name of methyl 6-methoxy-3-phenylmethoxypyridine-2-carboxylate (CID 22175139) is methyl 6-methoxy-3-phenylmethoxypyridine-2-carboxylate.
What is the SMILES notation for methyl 6-methoxy-3-phenylmethoxypyridine-2-carboxylate?
The canonical SMILES for methyl 6-methoxy-3-phenylmethoxypyridine-2-carboxylate is COC(=O)c1nc(OC)ccc1OCc1ccccc1.
What is the InChIKey of methyl 6-methoxy-3-phenylmethoxypyridine-2-carboxylate?
The InChIKey is LGOGLSSLIBDVGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO4/c1-18-13-9-8-12(14(16-13)15(17)19-2)20-10-11-6-4-3-5-7-11/h3-9H,10H2,1-2H3.
What are the key properties of methyl 6-methoxy-3-phenylmethoxypyridine-2-carboxylate?
methyl 6-methoxy-3-phenylmethoxypyridine-2-carboxylate has a molecular weight of 273.29 g/mol, XLogP of 2.46, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 6-methoxy-3-phenylmethoxypyridine-2-carboxylate is sourced from PubChem (CID 22175139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).