N-(5-tert-butyl-2-hydroxyphenyl)pentanamide

C15H23NO2 — CID 29265334

IUPACN-(5-tert-butyl-2-hydroxyphenyl)pentanamide
SMILESCCCCC(=O)Nc1cc(C(C)(C)C)ccc1O
InChIInChI=1S/C15H23NO2/c1-5-6-7-14(18)16-12-10-11(15(2,3)4)8-9-13(12)17/h8-10,17H,5-7H2,1-4H3,(H,16,18)
InChIKeyKKBUTYTVRVOCKG-UHFFFAOYSA-N
MW249.35 g/mol
LogP3.82
Rot. Bonds4

About N-(5-tert-butyl-2-hydroxyphenyl)pentanamide

N-(5-tert-butyl-2-hydroxyphenyl)pentanamide (PubChem CID 29265334) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is N-(5-tert-butyl-2-hydroxyphenyl)pentanamide.

Molecular Properties

Compound NameN-(5-tert-butyl-2-hydroxyphenyl)pentanamide
PubChem CID29265334
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC NameN-(5-tert-butyl-2-hydroxyphenyl)pentanamide
SMILESCCCCC(=O)Nc1cc(C(C)(C)C)ccc1O
InChIInChI=1S/C15H23NO2/c1-5-6-7-14(18)16-12-10-11(15(2,3)4)8-9-13(12)17/h8-10,17H,5-7H2,1-4H3,(H,16,18)
InChIKeyKKBUTYTVRVOCKG-UHFFFAOYSA-N
XLogP3.82
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-(5-tert-butyl-2-hydroxyphenyl)pentanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(5-tert-butyl-2-hydroxyphenyl)tetradecanamide
CID 58819419
N-(5-tert-butyl-2-hydroxyphenyl)-4-methoxybutanamide
CID 47266829
N,N'-bis(5-tert-butyl-2-hydroxyphenyl)oxamide
CID 10524086
N-(3,5-ditert-butyl-2-hydroxyphenyl)hexanamide
CID 126701347
N-(5-tert-butyl-2-hydroxyphenyl)-4-(cyclohexylcarbamoylamino)butanamide
CID 31031780
N-(2-hydroxy-5-phenylphenyl)octanamide
CID 155558351
5-amino-N-[2-hydroxy-5-(trifluoromethyl)phenyl]pentanamide
CID 81198138
3-[4-(4-tert-butylphenoxy)butanoylamino]-4-hydroxybenzoic acid
CID 108753977
(Z)-4-(5-tert-butyl-2-hydroxyanilino)pent-3-en-2-one
CID 139061491
N-(5-tert-butyl-2-hydroxyphenyl)-3-(3-methyl-2-oxobenzimidazol-1-yl)propanamide
CID 18225583
(Z)-4-(5-tert-butyl-2-hydroxyanilino)-4-oxobut-2-enoic acid
CID 101041653
N-[3-(5-tert-butyl-2-hydroxyanilino)-3-oxopropyl]thiophene-3-carboxamide
CID 29265430

Frequently Asked Questions

What is the IUPAC name of N-(5-tert-butyl-2-hydroxyphenyl)pentanamide?
The IUPAC name of N-(5-tert-butyl-2-hydroxyphenyl)pentanamide (CID 29265334) is N-(5-tert-butyl-2-hydroxyphenyl)pentanamide.
What is the SMILES notation for N-(5-tert-butyl-2-hydroxyphenyl)pentanamide?
The canonical SMILES for N-(5-tert-butyl-2-hydroxyphenyl)pentanamide is CCCCC(=O)Nc1cc(C(C)(C)C)ccc1O.
What is the InChIKey of N-(5-tert-butyl-2-hydroxyphenyl)pentanamide?
The InChIKey is KKBUTYTVRVOCKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-5-6-7-14(18)16-12-10-11(15(2,3)4)8-9-13(12)17/h8-10,17H,5-7H2,1-4H3,(H,16,18).
What are the key properties of N-(5-tert-butyl-2-hydroxyphenyl)pentanamide?
N-(5-tert-butyl-2-hydroxyphenyl)pentanamide has a molecular weight of 249.35 g/mol, XLogP of 3.82, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-tert-butyl-2-hydroxyphenyl)pentanamide is sourced from PubChem (CID 29265334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).