N-hexyl-N-(2-hydroxyethyl)benzamide

C15H23NO2 — CID 61215400

IUPACN-hexyl-N-(2-hydroxyethyl)benzamide
SMILESCCCCCCN(CCO)C(=O)c1ccccc1
InChIInChI=1S/C15H23NO2/c1-2-3-4-8-11-16(12-13-17)15(18)14-9-6-5-7-10-14/h5-7,9-10,17H,2-4,8,11-13H2,1H3
InChIKeyUNMCQKBREHDGBO-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.70
Rot. Bonds8

About N-hexyl-N-(2-hydroxyethyl)benzamide

N-hexyl-N-(2-hydroxyethyl)benzamide (PubChem CID 61215400) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is N-hexyl-N-(2-hydroxyethyl)benzamide.

Molecular Properties

Compound NameN-hexyl-N-(2-hydroxyethyl)benzamide
PubChem CID61215400
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC NameN-hexyl-N-(2-hydroxyethyl)benzamide
SMILESCCCCCCN(CCO)C(=O)c1ccccc1
InChIInChI=1S/C15H23NO2/c1-2-3-4-8-11-16(12-13-17)15(18)14-9-6-5-7-10-14/h5-7,9-10,17H,2-4,8,11-13H2,1H3
InChIKeyUNMCQKBREHDGBO-UHFFFAOYSA-N
XLogP2.70
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[hexyl(2-hydroxyethyl)carbamoyl]benzoic acid
CID 60949991
1-(2-hydroxyethyl)-3-phenyl-1-undecylurea
CID 70451899
N-butyl-N-(2-chloroethyl)benzamide
CID 63390876
4-ethyl-N,N-dihexylbenzamide
CID 533235
4-amino-N,N-didodecylbenzamide
CID 5077826
3-methyl-N,N-di(undecyl)benzamide
CID 533252
N,N-bis(6-aminohexyl)benzamide
CID 68737596
2,6-dichloro-N-hexyl-N-(2-hydroxyethyl)pyridine-4-carboxamide
CID 61052289
6-fluoro-N-hexyl-N-(2-hydroxyethyl)pyridine-3-carboxamide
CID 63979343
N-butyl-N-(2-hydroxyethyl)-4-[methyl(phenyl)sulfamoyl]benzamide
CID 78856047
N-butyl-N-decyl-4-ethylbenzamide
CID 91714679
N-(2-hydroxyethyl)-N-(2-methoxyethyl)benzamide
CID 115772786

Frequently Asked Questions

What is the IUPAC name of N-hexyl-N-(2-hydroxyethyl)benzamide?
The IUPAC name of N-hexyl-N-(2-hydroxyethyl)benzamide (CID 61215400) is N-hexyl-N-(2-hydroxyethyl)benzamide.
What is the SMILES notation for N-hexyl-N-(2-hydroxyethyl)benzamide?
The canonical SMILES for N-hexyl-N-(2-hydroxyethyl)benzamide is CCCCCCN(CCO)C(=O)c1ccccc1.
What is the InChIKey of N-hexyl-N-(2-hydroxyethyl)benzamide?
The InChIKey is UNMCQKBREHDGBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-2-3-4-8-11-16(12-13-17)15(18)14-9-6-5-7-10-14/h5-7,9-10,17H,2-4,8,11-13H2,1H3.
What are the key properties of N-hexyl-N-(2-hydroxyethyl)benzamide?
N-hexyl-N-(2-hydroxyethyl)benzamide has a molecular weight of 249.35 g/mol, XLogP of 2.70, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hexyl-N-(2-hydroxyethyl)benzamide is sourced from PubChem (CID 61215400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).