N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylpentanamide

C15H23NO2 — CID 43210202

IUPACN-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylpentanamide
SMILESCCCC(C)C(=O)N(CC)c1cc(O)ccc1C
InChIInChI=1S/C15H23NO2/c1-5-7-12(4)15(18)16(6-2)14-10-13(17)9-8-11(14)3/h8-10,12,17H,5-7H2,1-4H3
InChIKeyVTQDLIMTPAKDNW-UHFFFAOYSA-N
MW249.35 g/mol
LogP3.49
Rot. Bonds5

About N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylpentanamide

N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylpentanamide (PubChem CID 43210202) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylpentanamide.

Molecular Properties

Compound NameN-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylpentanamide
PubChem CID43210202
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC NameN-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylpentanamide
SMILESCCCC(C)C(=O)N(CC)c1cc(O)ccc1C
InChIInChI=1S/C15H23NO2/c1-5-7-12(4)15(18)16(6-2)14-10-13(17)9-8-11(14)3/h8-10,12,17H,5-7H2,1-4H3
InChIKeyVTQDLIMTPAKDNW-UHFFFAOYSA-N
XLogP3.49
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylbutanamide
CID 107734511
N-ethyl-2-methyl-N-(2-methylphenyl)pentanamide
CID 2890658
(2S)-2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-methylpentanamide
CID 107734446
2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-3,3-dimethylbutanamide
CID 107734495
N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-(propan-2-ylamino)acetamide
CID 107734471
4-[[ethyl-(5-hydroxy-2-methylphenyl)carbamoyl]amino]pentanoic acid
CID 107737106
N-ethyl-N-(5-hydroxy-2-methylphenyl)heptanamide
CID 114753046
(2R)-2-[[ethyl-(5-hydroxy-2-methylphenyl)carbamoyl]amino]-4-hydroxybutanoic acid
CID 107829638
N-ethyl-N-(5-hydroxy-2-methylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 66477100
N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-iodobenzamide
CID 28978793
2-[[ethyl-(5-hydroxy-2-methylphenyl)carbamoyl]amino]acetic acid
CID 107737112
2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-(1-methylpyrazol-4-yl)acetamide
CID 107734513

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylpentanamide?
The IUPAC name of N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylpentanamide (CID 43210202) is N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylpentanamide.
What is the SMILES notation for N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylpentanamide?
The canonical SMILES for N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylpentanamide is CCCC(C)C(=O)N(CC)c1cc(O)ccc1C.
What is the InChIKey of N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylpentanamide?
The InChIKey is VTQDLIMTPAKDNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-5-7-12(4)15(18)16(6-2)14-10-13(17)9-8-11(14)3/h8-10,12,17H,5-7H2,1-4H3.
What are the key properties of N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylpentanamide?
N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylpentanamide has a molecular weight of 249.35 g/mol, XLogP of 3.49, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylpentanamide is sourced from PubChem (CID 43210202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).