N-(2-hydroxyethyl)-2,4-dimethyl-N-(2-phenylethyl)benzamide

C19H23NO2 — CID 111122151

IUPACN-(2-hydroxyethyl)-2,4-dimethyl-N-(2-phenylethyl)benzamide
SMILESCc1ccc(C(=O)N(CCO)CCc2ccccc2)c(C)c1
InChIInChI=1S/C19H23NO2/c1-15-8-9-18(16(2)14-15)19(22)20(12-13-21)11-10-17-6-4-3-5-7-17/h3-9,14,21H,10-13H2,1-2H3
InChIKeyODNYJKTUOYNWAL-UHFFFAOYSA-N
MW297.40 g/mol
LogP2.98
Rot. Bonds6

About N-(2-hydroxyethyl)-2,4-dimethyl-N-(2-phenylethyl)benzamide

N-(2-hydroxyethyl)-2,4-dimethyl-N-(2-phenylethyl)benzamide (PubChem CID 111122151) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2,4-dimethyl-N-(2-phenylethyl)benzamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2,4-dimethyl-N-(2-phenylethyl)benzamide
PubChem CID111122151
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC NameN-(2-hydroxyethyl)-2,4-dimethyl-N-(2-phenylethyl)benzamide
SMILESCc1ccc(C(=O)N(CCO)CCc2ccccc2)c(C)c1
InChIInChI=1S/C19H23NO2/c1-15-8-9-18(16(2)14-15)19(22)20(12-13-21)11-10-17-6-4-3-5-7-17/h3-9,14,21H,10-13H2,1-2H3
InChIKeyODNYJKTUOYNWAL-UHFFFAOYSA-N
XLogP2.98
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-hydroxyethyl)-2-methyl-N-(2-phenylethyl)benzamide
CID 111122128
N-(2-hydroxyethyl)-3-methoxy-4-methyl-N-(2-phenylethyl)benzamide
CID 111122063
2,5-difluoro-N-(2-hydroxyethyl)-N-(2-phenylethyl)benzamide
CID 111122067
5-chloro-2-fluoro-N-(2-hydroxyethyl)-N-(2-phenylethyl)benzamide
CID 111122037
N,2,5-trimethyl-N-(2-phenylethyl)benzamide
CID 175917988
3-[2-hydroxyethyl-(2-methylbenzoyl)amino]propanoic acid
CID 82324584
N-benzyl-N-(2-hydroxyethyl)-2-methyl-5-sulfanylbenzamide
CID 107027966
N,N-bis(2-cyanoethyl)-2,4-dimethylbenzamide
CID 51180457
2-chloro-5-(dimethylsulfamoyl)-N-(2-hydroxyethyl)-N-(2-phenylethyl)benzamide
CID 86943587
2-bromo-N,N-bis(2-hydroxyethyl)-5-methylbenzamide
CID 81109663
N-(2-aminoethyl)-2,4-dimethyl-N-propylbenzamide
CID 61349150
N-(2-aminoethyl)-5-bromo-2-methyl-N-(2-phenylethyl)benzamide
CID 120884508

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2,4-dimethyl-N-(2-phenylethyl)benzamide?
The IUPAC name of N-(2-hydroxyethyl)-2,4-dimethyl-N-(2-phenylethyl)benzamide (CID 111122151) is N-(2-hydroxyethyl)-2,4-dimethyl-N-(2-phenylethyl)benzamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2,4-dimethyl-N-(2-phenylethyl)benzamide?
The canonical SMILES for N-(2-hydroxyethyl)-2,4-dimethyl-N-(2-phenylethyl)benzamide is Cc1ccc(C(=O)N(CCO)CCc2ccccc2)c(C)c1.
What is the InChIKey of N-(2-hydroxyethyl)-2,4-dimethyl-N-(2-phenylethyl)benzamide?
The InChIKey is ODNYJKTUOYNWAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-15-8-9-18(16(2)14-15)19(22)20(12-13-21)11-10-17-6-4-3-5-7-17/h3-9,14,21H,10-13H2,1-2H3.
What are the key properties of N-(2-hydroxyethyl)-2,4-dimethyl-N-(2-phenylethyl)benzamide?
N-(2-hydroxyethyl)-2,4-dimethyl-N-(2-phenylethyl)benzamide has a molecular weight of 297.40 g/mol, XLogP of 2.98, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2,4-dimethyl-N-(2-phenylethyl)benzamide is sourced from PubChem (CID 111122151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).