4-hydroxy-N-(3-methylbutan-2-yl)benzamide

C12H17NO2 — CID 43084897

IUPAC4-hydroxy-N-(3-methylbutan-2-yl)benzamide
SMILESCC(C)C(C)NC(=O)c1ccc(O)cc1
InChIInChI=1S/C12H17NO2/c1-8(2)9(3)13-12(15)10-4-6-11(14)7-5-10/h4-9,14H,1-3H3,(H,13,15)
InChIKeyZRRQOTFEJJCJKK-UHFFFAOYSA-N
MW207.27 g/mol
LogP2.17
Rot. Bonds3

About 4-hydroxy-N-(3-methylbutan-2-yl)benzamide

4-hydroxy-N-(3-methylbutan-2-yl)benzamide (PubChem CID 43084897) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is 4-hydroxy-N-(3-methylbutan-2-yl)benzamide.

Molecular Properties

Compound Name4-hydroxy-N-(3-methylbutan-2-yl)benzamide
PubChem CID43084897
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name4-hydroxy-N-(3-methylbutan-2-yl)benzamide
SMILESCC(C)C(C)NC(=O)c1ccc(O)cc1
InChIInChI=1S/C12H17NO2/c1-8(2)9(3)13-12(15)10-4-6-11(14)7-5-10/h4-9,14H,1-3H3,(H,13,15)
InChIKeyZRRQOTFEJJCJKK-UHFFFAOYSA-N
XLogP2.17
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-hydroxy-N-(3-methylbutan-2-yl)benzamide 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

4-acetyl-N-(3-methylbutan-2-yl)benzamide
CID 18712014
4-chloro-N-(3-methylbutan-2-yl)benzamide
CID 4263927
4-bromo-N-[(2R)-3-methylbutan-2-yl]benzamide
CID 40522020
3,5-dihydroxy-N-(3-methylbutan-2-yl)benzamide
CID 103891766
N-[(2R)-3-methylbutan-2-yl]-4-nitrobenzamide
CID 92515236
2-(diethylamino)-3-[(4-hydroxybenzoyl)amino]butanoic acid
CID 67056300
N-(4-aminobutan-2-yl)-4-hydroxybenzamide
CID 62092757
4-(difluoromethylsulfonyl)-N-(3-methylbutan-2-yl)benzamide
CID 51153952
N-[(2R)-3-methylbutan-2-yl]-4-(phenoxymethyl)benzamide
CID 41380086
N-[(2R,3R)-3-hydroxybutan-2-yl]-4-methylbenzamide
CID 167046854
1-[(4-fluorobenzoyl)amino]-3-(3-methylbutan-2-yl)urea
CID 47159837
6-chloro-N-[(2S)-3-methylbutan-2-yl]pyridine-3-carboxamide
CID 28880213

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(3-methylbutan-2-yl)benzamide?
The IUPAC name of 4-hydroxy-N-(3-methylbutan-2-yl)benzamide (CID 43084897) is 4-hydroxy-N-(3-methylbutan-2-yl)benzamide.
What is the SMILES notation for 4-hydroxy-N-(3-methylbutan-2-yl)benzamide?
The canonical SMILES for 4-hydroxy-N-(3-methylbutan-2-yl)benzamide is CC(C)C(C)NC(=O)c1ccc(O)cc1.
What is the InChIKey of 4-hydroxy-N-(3-methylbutan-2-yl)benzamide?
The InChIKey is ZRRQOTFEJJCJKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-8(2)9(3)13-12(15)10-4-6-11(14)7-5-10/h4-9,14H,1-3H3,(H,13,15).
What are the key properties of 4-hydroxy-N-(3-methylbutan-2-yl)benzamide?
4-hydroxy-N-(3-methylbutan-2-yl)benzamide has a molecular weight of 207.27 g/mol, XLogP of 2.17, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(3-methylbutan-2-yl)benzamide is sourced from PubChem (CID 43084897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).