4-methoxy-N-[(4-methyl-5-oxomorpholin-2-yl)methyl]benzamide

C14H18N2O4 — CID 110710086

IUPAC4-methoxy-N-[(4-methyl-5-oxomorpholin-2-yl)methyl]benzamide
SMILESCOc1ccc(C(=O)NCC2CN(C)C(=O)CO2)cc1
InChIInChI=1S/C14H18N2O4/c1-16-8-12(20-9-13(16)17)7-15-14(18)10-3-5-11(19-2)6-4-10/h3-6,12H,7-9H2,1-2H3,(H,15,18)
InChIKeyXLCLMFXSGGQPPI-UHFFFAOYSA-N
MW278.31 g/mol
LogP0.28
Rot. Bonds4

About 4-methoxy-N-[(4-methyl-5-oxomorpholin-2-yl)methyl]benzamide

4-methoxy-N-[(4-methyl-5-oxomorpholin-2-yl)methyl]benzamide (PubChem CID 110710086) has the molecular formula C14H18N2O4 and a molecular weight of 278.31 g/mol. Its IUPAC name is 4-methoxy-N-[(4-methyl-5-oxomorpholin-2-yl)methyl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[(4-methyl-5-oxomorpholin-2-yl)methyl]benzamide
PubChem CID110710086
Molecular FormulaC14H18N2O4
Molecular Weight278.31 g/mol
Exact Mass278.13
IUPAC Name4-methoxy-N-[(4-methyl-5-oxomorpholin-2-yl)methyl]benzamide
SMILESCOc1ccc(C(=O)NCC2CN(C)C(=O)CO2)cc1
InChIInChI=1S/C14H18N2O4/c1-16-8-12(20-9-13(16)17)7-15-14(18)10-3-5-11(19-2)6-4-10/h3-6,12H,7-9H2,1-2H3,(H,15,18)
InChIKeyXLCLMFXSGGQPPI-UHFFFAOYSA-N
XLogP0.28
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[(4-methyl-5-oxomorpholin-2-yl)methyl]benzamide?
The IUPAC name of 4-methoxy-N-[(4-methyl-5-oxomorpholin-2-yl)methyl]benzamide (CID 110710086) is 4-methoxy-N-[(4-methyl-5-oxomorpholin-2-yl)methyl]benzamide.
What is the SMILES notation for 4-methoxy-N-[(4-methyl-5-oxomorpholin-2-yl)methyl]benzamide?
The canonical SMILES for 4-methoxy-N-[(4-methyl-5-oxomorpholin-2-yl)methyl]benzamide is COc1ccc(C(=O)NCC2CN(C)C(=O)CO2)cc1.
What is the InChIKey of 4-methoxy-N-[(4-methyl-5-oxomorpholin-2-yl)methyl]benzamide?
The InChIKey is XLCLMFXSGGQPPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O4/c1-16-8-12(20-9-13(16)17)7-15-14(18)10-3-5-11(19-2)6-4-10/h3-6,12H,7-9H2,1-2H3,(H,15,18).
What are the key properties of 4-methoxy-N-[(4-methyl-5-oxomorpholin-2-yl)methyl]benzamide?
4-methoxy-N-[(4-methyl-5-oxomorpholin-2-yl)methyl]benzamide has a molecular weight of 278.31 g/mol, XLogP of 0.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[(4-methyl-5-oxomorpholin-2-yl)methyl]benzamide is sourced from PubChem (CID 110710086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).