N-benzyl-2-[N-(2-hydroxyethyl)anilino]-N-methylacetamide

C18H22N2O2 — CID 110877169

IUPACN-benzyl-2-[N-(2-hydroxyethyl)anilino]-N-methylacetamide
SMILESCN(Cc1ccccc1)C(=O)CN(CCO)c1ccccc1
InChIInChI=1S/C18H22N2O2/c1-19(14-16-8-4-2-5-9-16)18(22)15-20(12-13-21)17-10-6-3-7-11-17/h2-11,21H,12-15H2,1H3
InChIKeyQWWGCFTVELWPLZ-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.14
Rot. Bonds7

About N-benzyl-2-[N-(2-hydroxyethyl)anilino]-N-methylacetamide

N-benzyl-2-[N-(2-hydroxyethyl)anilino]-N-methylacetamide (PubChem CID 110877169) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is N-benzyl-2-[N-(2-hydroxyethyl)anilino]-N-methylacetamide.

Molecular Properties

Compound NameN-benzyl-2-[N-(2-hydroxyethyl)anilino]-N-methylacetamide
PubChem CID110877169
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC NameN-benzyl-2-[N-(2-hydroxyethyl)anilino]-N-methylacetamide
SMILESCN(Cc1ccccc1)C(=O)CN(CCO)c1ccccc1
InChIInChI=1S/C18H22N2O2/c1-19(14-16-8-4-2-5-9-16)18(22)15-20(12-13-21)17-10-6-3-7-11-17/h2-11,21H,12-15H2,1H3
InChIKeyQWWGCFTVELWPLZ-UHFFFAOYSA-N
XLogP2.14
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

acetic acid;2-[N-(2-hydroxyethyl)anilino]ethanol
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N-benzyl-N-methyl-2-[methyl(methylsulfonyl)amino]acetamide
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N-ethyl-2-[N-(2-hydroxyethyl)anilino]acetamide
CID 110880306
2-(N-benzylanilino)-N,N-diethylacetamide
CID 109005016
N,N'-dibenzyl-N'-(2-hydroxyethyl)-N-methyloxamide
CID 108518757
N-benzyl-N-methyl-2-[methylsulfonyl(2-phenylethyl)amino]acetamide
CID 7326582
N-benzyl-2-(2-hydroxyethylsulfanyl)-N-methylacetamide
CID 43392395
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3-[[N-(2-hydroxyethyl)anilino]methyl]-N,N-dimethylbenzamide
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Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[N-(2-hydroxyethyl)anilino]-N-methylacetamide?
The IUPAC name of N-benzyl-2-[N-(2-hydroxyethyl)anilino]-N-methylacetamide (CID 110877169) is N-benzyl-2-[N-(2-hydroxyethyl)anilino]-N-methylacetamide.
What is the SMILES notation for N-benzyl-2-[N-(2-hydroxyethyl)anilino]-N-methylacetamide?
The canonical SMILES for N-benzyl-2-[N-(2-hydroxyethyl)anilino]-N-methylacetamide is CN(Cc1ccccc1)C(=O)CN(CCO)c1ccccc1.
What is the InChIKey of N-benzyl-2-[N-(2-hydroxyethyl)anilino]-N-methylacetamide?
The InChIKey is QWWGCFTVELWPLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-19(14-16-8-4-2-5-9-16)18(22)15-20(12-13-21)17-10-6-3-7-11-17/h2-11,21H,12-15H2,1H3.
What are the key properties of N-benzyl-2-[N-(2-hydroxyethyl)anilino]-N-methylacetamide?
N-benzyl-2-[N-(2-hydroxyethyl)anilino]-N-methylacetamide has a molecular weight of 298.39 g/mol, XLogP of 2.14, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[N-(2-hydroxyethyl)anilino]-N-methylacetamide is sourced from PubChem (CID 110877169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).