2-ethyl-N-(4-hydroxypentyl)benzamide

C14H21NO2 — CID 107300304

IUPAC2-ethyl-N-(4-hydroxypentyl)benzamide
SMILESCCc1ccccc1C(=O)NCCCC(C)O
InChIInChI=1S/C14H21NO2/c1-3-12-8-4-5-9-13(12)14(17)15-10-6-7-11(2)16/h4-5,8-9,11,16H,3,6-7,10H2,1-2H3,(H,15,17)
InChIKeyXDOFADOFVXXPEF-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.14
Rot. Bonds6

About 2-ethyl-N-(4-hydroxypentyl)benzamide

2-ethyl-N-(4-hydroxypentyl)benzamide (PubChem CID 107300304) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-ethyl-N-(4-hydroxypentyl)benzamide.

Molecular Properties

Compound Name2-ethyl-N-(4-hydroxypentyl)benzamide
PubChem CID107300304
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-ethyl-N-(4-hydroxypentyl)benzamide
SMILESCCc1ccccc1C(=O)NCCCC(C)O
InChIInChI=1S/C14H21NO2/c1-3-12-8-4-5-9-13(12)14(17)15-10-6-7-11(2)16/h4-5,8-9,11,16H,3,6-7,10H2,1-2H3,(H,15,17)
InChIKeyXDOFADOFVXXPEF-UHFFFAOYSA-N
XLogP2.14
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(4-hydroxypentyl)-2-sulfanylbenzamide
CID 106137767
2-amino-N-(4-hydroxypentyl)benzamide
CID 106118828
2-ethyl-N-(6-hydroxyhexyl)benzamide
CID 103918854
2-ethyl-N-pent-4-ynylbenzamide
CID 103816602
N-(5-hydroxy-4-methylpentyl)-2-(methoxymethyl)benzamide
CID 103862006
2-fluoro-N-(4-methylpentyl)benzamide
CID 60738338
2,5-dibromo-N-(4-hydroxypentyl)benzamide
CID 107300307
N-(4-hydroxypentyl)quinoline-5-carboxamide
CID 107300441
2-(hydroxymethyl)-N-tetradecylbenzamide
CID 23299401
2-(methylamino)-N-(4-methylpentyl)benzamide
CID 61377674
N-(3,3-difluoro-2-hydroxypropyl)-2-ethylbenzamide
CID 103820546
5-ethyl-N-(4-hydroxypentyl)furan-2-carboxamide
CID 107299752

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(4-hydroxypentyl)benzamide?
The IUPAC name of 2-ethyl-N-(4-hydroxypentyl)benzamide (CID 107300304) is 2-ethyl-N-(4-hydroxypentyl)benzamide.
What is the SMILES notation for 2-ethyl-N-(4-hydroxypentyl)benzamide?
The canonical SMILES for 2-ethyl-N-(4-hydroxypentyl)benzamide is CCc1ccccc1C(=O)NCCCC(C)O.
What is the InChIKey of 2-ethyl-N-(4-hydroxypentyl)benzamide?
The InChIKey is XDOFADOFVXXPEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-3-12-8-4-5-9-13(12)14(17)15-10-6-7-11(2)16/h4-5,8-9,11,16H,3,6-7,10H2,1-2H3,(H,15,17).
What are the key properties of 2-ethyl-N-(4-hydroxypentyl)benzamide?
2-ethyl-N-(4-hydroxypentyl)benzamide has a molecular weight of 235.33 g/mol, XLogP of 2.14, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(4-hydroxypentyl)benzamide is sourced from PubChem (CID 107300304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).