2-ethoxy-N-(6-hydroxyhexyl)benzamide

C15H23NO3 — CID 103919109

IUPAC2-ethoxy-N-(6-hydroxyhexyl)benzamide
SMILESCCOc1ccccc1C(=O)NCCCCCCO
InChIInChI=1S/C15H23NO3/c1-2-19-14-10-6-5-9-13(14)15(18)16-11-7-3-4-8-12-17/h5-6,9-10,17H,2-4,7-8,11-12H2,1H3,(H,16,18)
InChIKeyVHGLLTDSTRGJJW-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.37
Rot. Bonds9

About 2-ethoxy-N-(6-hydroxyhexyl)benzamide

2-ethoxy-N-(6-hydroxyhexyl)benzamide (PubChem CID 103919109) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 2-ethoxy-N-(6-hydroxyhexyl)benzamide.

Molecular Properties

Compound Name2-ethoxy-N-(6-hydroxyhexyl)benzamide
PubChem CID103919109
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name2-ethoxy-N-(6-hydroxyhexyl)benzamide
SMILESCCOc1ccccc1C(=O)NCCCCCCO
InChIInChI=1S/C15H23NO3/c1-2-19-14-10-6-5-9-13(14)15(18)16-11-7-3-4-8-12-17/h5-6,9-10,17H,2-4,7-8,11-12H2,1H3,(H,16,18)
InChIKeyVHGLLTDSTRGJJW-UHFFFAOYSA-N
XLogP2.37
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-ethoxy-N-(2-hydroxyethyl)benzamide
CID 4088522
N-(4-chlorobutyl)-2-ethoxybenzamide
CID 106845375
2-ethoxy-N-[4-(3-hydroxypropylamino)-4-oxobutyl]benzamide
CID 78854842
2-ethoxy-N-[2-(3-hydroxypropylsulfanyl)ethyl]benzamide
CID 103767466
2-butoxy-N-[8-[(2-butoxybenzoyl)amino]octyl]benzamide
CID 17233378
2-ethoxy-N-(7-pyrrolidin-1-ylheptyl)benzamide
CID 47074532
2-ethoxy-N-pent-4-ynylbenzamide
CID 103709030
2-ethoxy-N-[3-[4-[3-[(2-ethoxybenzoyl)amino]propyl]piperazin-1-yl]propyl]benzamide
CID 2932757
3-[(2-ethoxybenzoyl)amino]propanoic acid
CID 665917
2-ethyl-N-(6-hydroxyhexyl)benzamide
CID 103918854
2-(difluoromethoxy)-N-(6-hydroxyhexyl)benzamide
CID 103918835
3-amino-2-ethoxy-N-(5-hydroxypentyl)benzamide
CID 107316231

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(6-hydroxyhexyl)benzamide?
The IUPAC name of 2-ethoxy-N-(6-hydroxyhexyl)benzamide (CID 103919109) is 2-ethoxy-N-(6-hydroxyhexyl)benzamide.
What is the SMILES notation for 2-ethoxy-N-(6-hydroxyhexyl)benzamide?
The canonical SMILES for 2-ethoxy-N-(6-hydroxyhexyl)benzamide is CCOc1ccccc1C(=O)NCCCCCCO.
What is the InChIKey of 2-ethoxy-N-(6-hydroxyhexyl)benzamide?
The InChIKey is VHGLLTDSTRGJJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-2-19-14-10-6-5-9-13(14)15(18)16-11-7-3-4-8-12-17/h5-6,9-10,17H,2-4,7-8,11-12H2,1H3,(H,16,18).
What are the key properties of 2-ethoxy-N-(6-hydroxyhexyl)benzamide?
2-ethoxy-N-(6-hydroxyhexyl)benzamide has a molecular weight of 265.35 g/mol, XLogP of 2.37, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(6-hydroxyhexyl)benzamide is sourced from PubChem (CID 103919109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).