3,4-dimethyl-2-morpholin-4-ylbenzamide

C13H18N2O2 — CID 155069283

IUPAC3,4-dimethyl-2-morpholin-4-ylbenzamide
SMILESCc1ccc(C(N)=O)c(N2CCOCC2)c1C
InChIInChI=1S/C13H18N2O2/c1-9-3-4-11(13(14)16)12(10(9)2)15-5-7-17-8-6-15/h3-4H,5-8H2,1-2H3,(H2,14,16)
InChIKeyBQSGZYYIFSMZLM-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.24
Rot. Bonds2

About 3,4-dimethyl-2-morpholin-4-ylbenzamide

3,4-dimethyl-2-morpholin-4-ylbenzamide (PubChem CID 155069283) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 3,4-dimethyl-2-morpholin-4-ylbenzamide.

Molecular Properties

Compound Name3,4-dimethyl-2-morpholin-4-ylbenzamide
PubChem CID155069283
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name3,4-dimethyl-2-morpholin-4-ylbenzamide
SMILESCc1ccc(C(N)=O)c(N2CCOCC2)c1C
InChIInChI=1S/C13H18N2O2/c1-9-3-4-11(13(14)16)12(10(9)2)15-5-7-17-8-6-15/h3-4H,5-8H2,1-2H3,(H2,14,16)
InChIKeyBQSGZYYIFSMZLM-UHFFFAOYSA-N
XLogP1.24
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-fluoro-2-morpholin-4-ylbenzamide
CID 157343008
2-hydroxy-2-methyl-1-(2-methyl-3,4-dimorpholin-4-ylphenyl)propan-1-one
CID 68739637
3,4-dimethyl-6-morpholin-4-ylpyridine-2-carboxamide
CID 175406117
2-hydroxy-3,4-dimethyl-N-[(4-morpholin-4-ylphenyl)methyl]benzamide
CID 86830423
3-(morpholin-4-ylmethyl)-2-pyrrolidin-1-ylbenzamide
CID 118695162
2-morpholin-4-yl-4-nitrobenzamide
CID 118024291
2,3-dimethyl-5-morpholin-4-ylbenzoic acid
CID 79694761
methyl 2-methyl-4-morpholin-4-ylbenzoate
CID 90024135
2,4-dimethylbenzene-1,3-dicarboxamide
CID 19767105
4-methyl-3-morpholin-4-yl-2-[2-(4-nitrophenyl)ethenyl]benzoic acid
CID 175443763
1-(4-amino-2-morpholin-4-ylphenyl)ethanone
CID 134460637
2-methyl-6-morpholin-4-ylpyridine-3-carboxylic acid
CID 67287742

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-2-morpholin-4-ylbenzamide?
The IUPAC name of 3,4-dimethyl-2-morpholin-4-ylbenzamide (CID 155069283) is 3,4-dimethyl-2-morpholin-4-ylbenzamide.
What is the SMILES notation for 3,4-dimethyl-2-morpholin-4-ylbenzamide?
The canonical SMILES for 3,4-dimethyl-2-morpholin-4-ylbenzamide is Cc1ccc(C(N)=O)c(N2CCOCC2)c1C.
What is the InChIKey of 3,4-dimethyl-2-morpholin-4-ylbenzamide?
The InChIKey is BQSGZYYIFSMZLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-9-3-4-11(13(14)16)12(10(9)2)15-5-7-17-8-6-15/h3-4H,5-8H2,1-2H3,(H2,14,16).
What are the key properties of 3,4-dimethyl-2-morpholin-4-ylbenzamide?
3,4-dimethyl-2-morpholin-4-ylbenzamide has a molecular weight of 234.30 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-2-morpholin-4-ylbenzamide is sourced from PubChem (CID 155069283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).