N-[(2-methoxy-4-pyridinyl)methyl]-3-methylmorpholine-4-carboxamide

C13H19N3O3 — CID 71940734

IUPACN-[(2-methoxy-4-pyridinyl)methyl]-3-methylmorpholine-4-carboxamide
SMILESCOc1cc(CNC(=O)N2CCOCC2C)ccn1
InChIInChI=1S/C13H19N3O3/c1-10-9-19-6-5-16(10)13(17)15-8-11-3-4-14-12(7-11)18-2/h3-4,7,10H,5-6,8-9H2,1-2H3,(H,15,17)
InChIKeyHLIAEUBAROPANV-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.02
Rot. Bonds3

About N-[(2-methoxy-4-pyridinyl)methyl]-3-methylmorpholine-4-carboxamide

N-[(2-methoxy-4-pyridinyl)methyl]-3-methylmorpholine-4-carboxamide (PubChem CID 71940734) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is N-[(2-methoxy-4-pyridinyl)methyl]-3-methylmorpholine-4-carboxamide.

Molecular Properties

Compound NameN-[(2-methoxy-4-pyridinyl)methyl]-3-methylmorpholine-4-carboxamide
PubChem CID71940734
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC NameN-[(2-methoxy-4-pyridinyl)methyl]-3-methylmorpholine-4-carboxamide
SMILESCOc1cc(CNC(=O)N2CCOCC2C)ccn1
InChIInChI=1S/C13H19N3O3/c1-10-9-19-6-5-16(10)13(17)15-8-11-3-4-14-12(7-11)18-2/h3-4,7,10H,5-6,8-9H2,1-2H3,(H,15,17)
InChIKeyHLIAEUBAROPANV-UHFFFAOYSA-N
XLogP1.02
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-methoxy-4-pyridinyl)methyl]-3-(oxan-4-ylmethyl)morpholine-4-carboxamide
CID 136568232
(3S)-3-methyl-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]morpholine-4-carboxamide
CID 94066498
N-[(2-methoxy-4-pyridinyl)methyl]morpholine-4-carboxamide
CID 34677256
(2R)-N-[(2-methoxy-4-pyridinyl)methyl]-2-phenylazetidine-1-carboxamide
CID 94052771
2-ethyl-N-[(2-methoxy-4-pyridinyl)methyl]piperidine-1-carboxamide
CID 87003451
(2S)-2-(cyclohexylmethyl)-N-[(2-methoxy-4-pyridinyl)methyl]pyrrolidine-1-carboxamide
CID 94871507
(2R)-2-(cyclohexylmethyl)-N-[(2-methoxy-4-pyridinyl)methyl]pyrrolidine-1-carboxamide
CID 96999867
(3S)-3-methyl-N-[[3-(methylsulfamoyl)phenyl]methyl]morpholine-4-carboxamide
CID 94031214
(3S)-3-methyl-N-[[6-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]morpholine-4-carboxamide
CID 94180412
2-(4-chlorophenyl)-N-[(2-methoxy-4-pyridinyl)methyl]morpholine-4-carboxamide
CID 87036072
N-[(2-methoxy-4-pyridinyl)methyl]cyclopropanecarboxamide
CID 60715595
N-[(2-methoxy-4-pyridinyl)methyl]-6-morpholin-4-ylpyridine-3-carboxamide
CID 18167458

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxy-4-pyridinyl)methyl]-3-methylmorpholine-4-carboxamide?
The IUPAC name of N-[(2-methoxy-4-pyridinyl)methyl]-3-methylmorpholine-4-carboxamide (CID 71940734) is N-[(2-methoxy-4-pyridinyl)methyl]-3-methylmorpholine-4-carboxamide.
What is the SMILES notation for N-[(2-methoxy-4-pyridinyl)methyl]-3-methylmorpholine-4-carboxamide?
The canonical SMILES for N-[(2-methoxy-4-pyridinyl)methyl]-3-methylmorpholine-4-carboxamide is COc1cc(CNC(=O)N2CCOCC2C)ccn1.
What is the InChIKey of N-[(2-methoxy-4-pyridinyl)methyl]-3-methylmorpholine-4-carboxamide?
The InChIKey is HLIAEUBAROPANV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c1-10-9-19-6-5-16(10)13(17)15-8-11-3-4-14-12(7-11)18-2/h3-4,7,10H,5-6,8-9H2,1-2H3,(H,15,17).
What are the key properties of N-[(2-methoxy-4-pyridinyl)methyl]-3-methylmorpholine-4-carboxamide?
N-[(2-methoxy-4-pyridinyl)methyl]-3-methylmorpholine-4-carboxamide has a molecular weight of 265.31 g/mol, XLogP of 1.02, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxy-4-pyridinyl)methyl]-3-methylmorpholine-4-carboxamide is sourced from PubChem (CID 71940734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).