N-ethyl-N-(3-hydroxyphenyl)heptanamide

C15H23NO2 — CID 107736474

IUPACN-ethyl-N-(3-hydroxyphenyl)heptanamide
SMILESCCCCCCC(=O)N(CC)c1cccc(O)c1
InChIInChI=1S/C15H23NO2/c1-3-5-6-7-11-15(18)16(4-2)13-9-8-10-14(17)12-13/h8-10,12,17H,3-7,11H2,1-2H3
InChIKeyUXHQZHUANZKLDS-UHFFFAOYSA-N
MW249.35 g/mol
LogP3.72
Rot. Bonds7

About N-ethyl-N-(3-hydroxyphenyl)heptanamide

N-ethyl-N-(3-hydroxyphenyl)heptanamide (PubChem CID 107736474) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is N-ethyl-N-(3-hydroxyphenyl)heptanamide.

Molecular Properties

Compound NameN-ethyl-N-(3-hydroxyphenyl)heptanamide
PubChem CID107736474
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC NameN-ethyl-N-(3-hydroxyphenyl)heptanamide
SMILESCCCCCCC(=O)N(CC)c1cccc(O)c1
InChIInChI=1S/C15H23NO2/c1-3-5-6-7-11-15(18)16(4-2)13-9-8-10-14(17)12-13/h8-10,12,17H,3-7,11H2,1-2H3
InChIKeyUXHQZHUANZKLDS-UHFFFAOYSA-N
XLogP3.72
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 53.72
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

N-(3-aminophenyl)-N-ethyldecanamide
CID 65448348
N-(3-hydroxyphenyl)-N-methylnonanamide
CID 107736082
N-ethyl-N-phenyloctadecanamide
CID 151424183
2-amino-N-ethyl-N-(3-hydroxyphenyl)acetamide
CID 107734970
N-ethyl-2-(2-hydroxyphenyl)-N-(3-hydroxyphenyl)acetamide
CID 107735690
N-(3-hydroxyphenyl)-N-methylpentanamide
CID 107735913
ethyl-(3-hydroxyphenyl)carbamic acid
CID 20544636
N-ethyl-N,2-bis(3-hydroxyphenyl)acetamide
CID 107735678
N-ethyl-N-(3-hydroxyphenyl)-3-methylbutanamide
CID 107736260
N-ethyl-N-(5-hydroxy-2-methylphenyl)heptanamide
CID 114753046
N-[4-(aminomethyl)phenyl]-N-ethylhexanamide
CID 43275627
benzene-1,3-diol;decanoic acid
CID 175490572

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(3-hydroxyphenyl)heptanamide?
The IUPAC name of N-ethyl-N-(3-hydroxyphenyl)heptanamide (CID 107736474) is N-ethyl-N-(3-hydroxyphenyl)heptanamide.
What is the SMILES notation for N-ethyl-N-(3-hydroxyphenyl)heptanamide?
The canonical SMILES for N-ethyl-N-(3-hydroxyphenyl)heptanamide is CCCCCCC(=O)N(CC)c1cccc(O)c1.
What is the InChIKey of N-ethyl-N-(3-hydroxyphenyl)heptanamide?
The InChIKey is UXHQZHUANZKLDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-3-5-6-7-11-15(18)16(4-2)13-9-8-10-14(17)12-13/h8-10,12,17H,3-7,11H2,1-2H3.
What are the key properties of N-ethyl-N-(3-hydroxyphenyl)heptanamide?
N-ethyl-N-(3-hydroxyphenyl)heptanamide has a molecular weight of 249.35 g/mol, XLogP of 3.72, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(3-hydroxyphenyl)heptanamide is sourced from PubChem (CID 107736474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).