4-methyl-N-[(4-methylmorpholin-2-yl)methyl]benzamide

C14H20N2O2 — CID 49094811

IUPAC4-methyl-N-[(4-methylmorpholin-2-yl)methyl]benzamide
SMILESCc1ccc(C(=O)NCC2CN(C)CCO2)cc1
InChIInChI=1S/C14H20N2O2/c1-11-3-5-12(6-4-11)14(17)15-9-13-10-16(2)7-8-18-13/h3-6,13H,7-10H2,1-2H3,(H,15,17)
InChIKeyICBSMQSMECLZBR-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.06
Rot. Bonds3

About 4-methyl-N-[(4-methylmorpholin-2-yl)methyl]benzamide

4-methyl-N-[(4-methylmorpholin-2-yl)methyl]benzamide (PubChem CID 49094811) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 4-methyl-N-[(4-methylmorpholin-2-yl)methyl]benzamide.

Molecular Properties

Compound Name4-methyl-N-[(4-methylmorpholin-2-yl)methyl]benzamide
PubChem CID49094811
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name4-methyl-N-[(4-methylmorpholin-2-yl)methyl]benzamide
SMILESCc1ccc(C(=O)NCC2CN(C)CCO2)cc1
InChIInChI=1S/C14H20N2O2/c1-11-3-5-12(6-4-11)14(17)15-9-13-10-16(2)7-8-18-13/h3-6,13H,7-10H2,1-2H3,(H,15,17)
InChIKeyICBSMQSMECLZBR-UHFFFAOYSA-N
XLogP1.06
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-bromo-N-[(4-methylmorpholin-2-yl)methyl]benzamide
CID 49094765
4-chloro-N-[(4-methylmorpholin-2-yl)methyl]benzamide
CID 49094780
4-amino-3-fluoro-N-[(4-methylmorpholin-2-yl)methyl]benzamide
CID 79078520
4-fluoro-N-[(4-methylmorpholin-2-yl)methyl]-3-sulfanylbenzamide
CID 107031927
4-(1H-benzimidazol-2-yl)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]benzamide
CID 126452002
2-amino-N-[(4-methylmorpholin-2-yl)methyl]-2-(4-methylphenyl)acetamide
CID 106312498
4-methyl-N-[[(2S)-oxiran-2-yl]methyl]benzamide
CID 97180653
6-ethoxy-N-[(4-methylmorpholin-2-yl)methyl]pyridine-3-carboxamide
CID 49093596
2-fluoro-3-methyl-N-[(4-methylmorpholin-2-yl)methyl]benzamide
CID 80712225
3-(chloromethyl)-N-[(4-methylmorpholin-2-yl)methyl]benzamide
CID 79082923
5-[(4-methylmorpholin-2-yl)methylcarbamoyl]furan-3-carboxylic acid
CID 113432368
N-[(4-methylmorpholin-2-yl)methyl]-2-phenylacetamide
CID 110710224

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(4-methylmorpholin-2-yl)methyl]benzamide?
The IUPAC name of 4-methyl-N-[(4-methylmorpholin-2-yl)methyl]benzamide (CID 49094811) is 4-methyl-N-[(4-methylmorpholin-2-yl)methyl]benzamide.
What is the SMILES notation for 4-methyl-N-[(4-methylmorpholin-2-yl)methyl]benzamide?
The canonical SMILES for 4-methyl-N-[(4-methylmorpholin-2-yl)methyl]benzamide is Cc1ccc(C(=O)NCC2CN(C)CCO2)cc1.
What is the InChIKey of 4-methyl-N-[(4-methylmorpholin-2-yl)methyl]benzamide?
The InChIKey is ICBSMQSMECLZBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-11-3-5-12(6-4-11)14(17)15-9-13-10-16(2)7-8-18-13/h3-6,13H,7-10H2,1-2H3,(H,15,17).
What are the key properties of 4-methyl-N-[(4-methylmorpholin-2-yl)methyl]benzamide?
4-methyl-N-[(4-methylmorpholin-2-yl)methyl]benzamide has a molecular weight of 248.33 g/mol, XLogP of 1.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(4-methylmorpholin-2-yl)methyl]benzamide is sourced from PubChem (CID 49094811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).