methyl 2-methoxy-5-(morpholin-4-ylmethyl)pyridine-3-carboxylate

C13H18N2O4 — CID 67106461

IUPACmethyl 2-methoxy-5-(morpholin-4-ylmethyl)pyridine-3-carboxylate
SMILESCOC(=O)c1cc(CN2CCOCC2)cnc1OC
InChIInChI=1S/C13H18N2O4/c1-17-12-11(13(16)18-2)7-10(8-14-12)9-15-3-5-19-6-4-15/h7-8H,3-6,9H2,1-2H3
InChIKeyQOOCSNMMYOHYBW-UHFFFAOYSA-N
MW266.30 g/mol
LogP0.71
Rot. Bonds4

About methyl 2-methoxy-5-(morpholin-4-ylmethyl)pyridine-3-carboxylate

methyl 2-methoxy-5-(morpholin-4-ylmethyl)pyridine-3-carboxylate (PubChem CID 67106461) has the molecular formula C13H18N2O4 and a molecular weight of 266.30 g/mol. Its IUPAC name is methyl 2-methoxy-5-(morpholin-4-ylmethyl)pyridine-3-carboxylate.

Molecular Properties

Compound Namemethyl 2-methoxy-5-(morpholin-4-ylmethyl)pyridine-3-carboxylate
PubChem CID67106461
Molecular FormulaC13H18N2O4
Molecular Weight266.30 g/mol
Exact Mass266.13
IUPAC Namemethyl 2-methoxy-5-(morpholin-4-ylmethyl)pyridine-3-carboxylate
SMILESCOC(=O)c1cc(CN2CCOCC2)cnc1OC
InChIInChI=1S/C13H18N2O4/c1-17-12-11(13(16)18-2)7-10(8-14-12)9-15-3-5-19-6-4-15/h7-8H,3-6,9H2,1-2H3
InChIKeyQOOCSNMMYOHYBW-UHFFFAOYSA-N
XLogP0.71
TPSA60.89 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 50.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

methyl 2-methoxy-4-(morpholin-4-ylmethyl)benzoate
CID 66876950
methyl 5-(morpholin-4-ylmethyl)-2-pyrrolidin-1-ylbenzoate
CID 118695822
methyl 2-(hydroxymethyl)-4-(morpholin-4-ylmethyl)benzoate
CID 58137671
methyl 4-(morpholin-4-ylmethyl)benzoate
CID 10466592
methyl 4-methoxy-2-(morpholin-4-ylmethyl)benzoate
CID 67322163
2-methoxy-5-(morpholin-4-ylmethyl)benzoic acid
CID 46785387
methyl 2-methoxy-5-[[[3-(morpholin-4-ylmethyl)phenyl]methylcarbamoylamino]methyl]benzoate
CID 55921387
1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[5-(morpholin-4-ylmethyl)-2-pyridinyl]urea
CID 75456130
methyl 3-bromo-2-(morpholin-4-ylmethyl)benzoate
CID 172876070
methyl 1-methyl-6-(morpholin-4-ylmethyl)-4,4-dioxo-4λ6,1,2-benzothiadiazine-3-carboxylate
CID 22397175
dimethyl 5-[[4-(morpholin-4-ylmethyl)benzoyl]amino]benzene-1,3-dicarboxylate
CID 9045335
5-methoxy-3-methyl-N-[5-(morpholin-4-ylmethyl)-2-pyridinyl]-1-benzothiophene-2-carboxamide
CID 75469958

Frequently Asked Questions

What is the IUPAC name of methyl 2-methoxy-5-(morpholin-4-ylmethyl)pyridine-3-carboxylate?
The IUPAC name of methyl 2-methoxy-5-(morpholin-4-ylmethyl)pyridine-3-carboxylate (CID 67106461) is methyl 2-methoxy-5-(morpholin-4-ylmethyl)pyridine-3-carboxylate.
What is the SMILES notation for methyl 2-methoxy-5-(morpholin-4-ylmethyl)pyridine-3-carboxylate?
The canonical SMILES for methyl 2-methoxy-5-(morpholin-4-ylmethyl)pyridine-3-carboxylate is COC(=O)c1cc(CN2CCOCC2)cnc1OC.
What is the InChIKey of methyl 2-methoxy-5-(morpholin-4-ylmethyl)pyridine-3-carboxylate?
The InChIKey is QOOCSNMMYOHYBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O4/c1-17-12-11(13(16)18-2)7-10(8-14-12)9-15-3-5-19-6-4-15/h7-8H,3-6,9H2,1-2H3.
What are the key properties of methyl 2-methoxy-5-(morpholin-4-ylmethyl)pyridine-3-carboxylate?
methyl 2-methoxy-5-(morpholin-4-ylmethyl)pyridine-3-carboxylate has a molecular weight of 266.30 g/mol, XLogP of 0.71, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-methoxy-5-(morpholin-4-ylmethyl)pyridine-3-carboxylate is sourced from PubChem (CID 67106461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).