N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide

C13H19NO3 — CID 113339830

IUPACN-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide
SMILESCOCCN(CCO)C(=O)c1ccccc1C
InChIInChI=1S/C13H19NO3/c1-11-5-3-4-6-12(11)13(16)14(7-9-15)8-10-17-2/h3-6,15H,7-10H2,1-2H3
InChIKeyIJJOVUYHAQQGAM-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.08
Rot. Bonds6

About N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide

N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide (PubChem CID 113339830) has the molecular formula C13H19NO3 and a molecular weight of 237.30 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide
PubChem CID113339830
Molecular FormulaC13H19NO3
Molecular Weight237.30 g/mol
Exact Mass237.14
IUPAC NameN-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide
SMILESCOCCN(CCO)C(=O)c1ccccc1C
InChIInChI=1S/C13H19NO3/c1-11-5-3-4-6-12(11)13(16)14(7-9-15)8-10-17-2/h3-6,15H,7-10H2,1-2H3
InChIKeyIJJOVUYHAQQGAM-UHFFFAOYSA-N
XLogP1.08
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-bromo-N-(2-hydroxyethyl)-N-(2-methoxyethyl)benzamide
CID 115772513
4-amino-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide
CID 113467625
2-hydroxy-N,N-bis(2-methoxyethyl)-3-methylbenzamide
CID 60653742
N-(2-hydroxyethyl)-N-(2-methoxyethyl)benzamide
CID 115772786
N,N-bis(2-hydroxyethyl)-2,3-dimethylbenzamide
CID 60653153
5-bromo-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide
CID 113351116
3-[2-hydroxyethyl-(2-methylbenzoyl)amino]propanoic acid
CID 82324584
4-hydrazinyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide
CID 113468064
N-(2-hydroxyethyl)-2-methyl-N-(2-phenylethyl)benzamide
CID 111122128
2-methoxy-N,N-bis(2-methoxyethyl)benzamide
CID 51072625
3-chloro-2-fluoro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)benzamide
CID 115902215
2-fluoro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)-4-methylbenzamide
CID 115902345

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide?
The IUPAC name of N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide (CID 113339830) is N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide is COCCN(CCO)C(=O)c1ccccc1C.
What is the InChIKey of N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide?
The InChIKey is IJJOVUYHAQQGAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO3/c1-11-5-3-4-6-12(11)13(16)14(7-9-15)8-10-17-2/h3-6,15H,7-10H2,1-2H3.
What are the key properties of N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide?
N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide has a molecular weight of 237.30 g/mol, XLogP of 1.08, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-(2-methoxyethyl)-2-methylbenzamide is sourced from PubChem (CID 113339830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).