methyl 4-[(6-methoxy-2-pyridinyl)methyl]morpholine-3-carboxylate

C13H18N2O4 — CID 113247750

IUPACmethyl 4-[(6-methoxy-2-pyridinyl)methyl]morpholine-3-carboxylate
SMILESCOC(=O)C1COCCN1Cc1cccc(OC)n1
InChIInChI=1S/C13H18N2O4/c1-17-12-5-3-4-10(14-12)8-15-6-7-19-9-11(15)13(16)18-2/h3-5,11H,6-9H2,1-2H3
InChIKeyHFMZHVCIBPLQTH-UHFFFAOYSA-N
MW266.30 g/mol
LogP0.46
Rot. Bonds4

About methyl 4-[(6-methoxy-2-pyridinyl)methyl]morpholine-3-carboxylate

methyl 4-[(6-methoxy-2-pyridinyl)methyl]morpholine-3-carboxylate (PubChem CID 113247750) has the molecular formula C13H18N2O4 and a molecular weight of 266.30 g/mol. Its IUPAC name is methyl 4-[(6-methoxy-2-pyridinyl)methyl]morpholine-3-carboxylate.

Molecular Properties

Compound Namemethyl 4-[(6-methoxy-2-pyridinyl)methyl]morpholine-3-carboxylate
PubChem CID113247750
Molecular FormulaC13H18N2O4
Molecular Weight266.30 g/mol
Exact Mass266.13
IUPAC Namemethyl 4-[(6-methoxy-2-pyridinyl)methyl]morpholine-3-carboxylate
SMILESCOC(=O)C1COCCN1Cc1cccc(OC)n1
InChIInChI=1S/C13H18N2O4/c1-17-12-5-3-4-10(14-12)8-15-6-7-19-9-11(15)13(16)18-2/h3-5,11H,6-9H2,1-2H3
InChIKeyHFMZHVCIBPLQTH-UHFFFAOYSA-N
XLogP0.46
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 ≤ 50.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

methyl 4-hydroxy-1-[(6-methoxy-2-pyridinyl)methyl]pyrrolidine-2-carboxylate
CID 112632824
methyl 4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]morpholine-3-carboxylate
CID 115670474
2-[2-[(3-methoxycarbonylmorpholin-4-yl)methyl]phenyl]acetic acid
CID 104775095
methyl 4-[(2-fluorophenyl)methyl]morpholine-3-carboxylate
CID 113247715
methyl 4-[(3-chloro-2-fluorophenyl)methyl]morpholine-3-carboxylate
CID 103886869
methyl 4-[(4-tert-butyl-1,3-thiazol-2-yl)methyl]morpholine-3-carboxylate
CID 115688127
methyl 4-[[2-(trifluoromethyl)phenyl]methyl]morpholine-3-carboxylate
CID 115670698
methyl 4-[(5-chloro-2-methoxyphenyl)methyl]morpholine-3-carboxylate
CID 115670695
methyl 4-(2-hydroxy-2-phenylpropyl)morpholine-3-carboxylate
CID 104775007
methyl 4-[(2-methoxycarbonylfuran-3-yl)methyl]morpholine-3-carboxylate
CID 115670655
methyl 4-[(2,4-difluorophenyl)methyl]morpholine-3-carboxylate
CID 113253204
methyl 4-[(5-fluoro-2-methylphenyl)methyl]morpholine-3-carboxylate
CID 115970488

Frequently Asked Questions

What is the IUPAC name of methyl 4-[(6-methoxy-2-pyridinyl)methyl]morpholine-3-carboxylate?
The IUPAC name of methyl 4-[(6-methoxy-2-pyridinyl)methyl]morpholine-3-carboxylate (CID 113247750) is methyl 4-[(6-methoxy-2-pyridinyl)methyl]morpholine-3-carboxylate.
What is the SMILES notation for methyl 4-[(6-methoxy-2-pyridinyl)methyl]morpholine-3-carboxylate?
The canonical SMILES for methyl 4-[(6-methoxy-2-pyridinyl)methyl]morpholine-3-carboxylate is COC(=O)C1COCCN1Cc1cccc(OC)n1.
What is the InChIKey of methyl 4-[(6-methoxy-2-pyridinyl)methyl]morpholine-3-carboxylate?
The InChIKey is HFMZHVCIBPLQTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O4/c1-17-12-5-3-4-10(14-12)8-15-6-7-19-9-11(15)13(16)18-2/h3-5,11H,6-9H2,1-2H3.
What are the key properties of methyl 4-[(6-methoxy-2-pyridinyl)methyl]morpholine-3-carboxylate?
methyl 4-[(6-methoxy-2-pyridinyl)methyl]morpholine-3-carboxylate has a molecular weight of 266.30 g/mol, XLogP of 0.46, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-[(6-methoxy-2-pyridinyl)methyl]morpholine-3-carboxylate is sourced from PubChem (CID 113247750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).