N-(4-hydroxyphenyl)-2-methylpentanamide

C12H17NO2 — CID 43210200

IUPACN-(4-hydroxyphenyl)-2-methylpentanamide
SMILESCCCC(C)C(=O)Nc1ccc(O)cc1
InChIInChI=1S/C12H17NO2/c1-3-4-9(2)12(15)13-10-5-7-11(14)8-6-10/h5-9,14H,3-4H2,1-2H3,(H,13,15)
InChIKeyZXOVWOHUVXPTES-UHFFFAOYSA-N
MW207.27 g/mol
LogP2.77
Rot. Bonds4

About N-(4-hydroxyphenyl)-2-methylpentanamide

N-(4-hydroxyphenyl)-2-methylpentanamide (PubChem CID 43210200) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is N-(4-hydroxyphenyl)-2-methylpentanamide.

Molecular Properties

Compound NameN-(4-hydroxyphenyl)-2-methylpentanamide
PubChem CID43210200
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC NameN-(4-hydroxyphenyl)-2-methylpentanamide
SMILESCCCC(C)C(=O)Nc1ccc(O)cc1
InChIInChI=1S/C12H17NO2/c1-3-4-9(2)12(15)13-10-5-7-11(14)8-6-10/h5-9,14H,3-4H2,1-2H3,(H,13,15)
InChIKeyZXOVWOHUVXPTES-UHFFFAOYSA-N
XLogP2.77
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2S)-N-(4-acetamidophenyl)-2-methylpentanamide
CID 670216
2-methyl-N-phenylpentanamide
CID 4627801
N-[4-(bromomethyl)phenyl]-2-methylpentanamide
CID 114310848
[amino-[4-(2-methylpentanoylamino)phenyl]methylidene]azanium
CID 21349582
N-methyl-4-(2-methylpentanoylamino)benzamide
CID 75981619
(2R)-2-methyl-N-(4-sulfamoylphenyl)pentanamide
CID 670213
N-(4-carbamothioylphenyl)-2-methylpentanamide
CID 43210162
(2S)-N-[4-(cyanomethyl)phenyl]-2-methylpentanamide
CID 94187740
N-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]-2-methylpentanamide
CID 43210178
N-(3-amino-4-ethylphenyl)-2-methylpentanamide
CID 43550225
2-methyl-N-[4-[1-[4-(2-methylpentanoylamino)phenyl]cyclohexyl]phenyl]pentanamide
CID 4831534
N-(6-amino-3-pyridinyl)-2-methylpentanamide
CID 62899385

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxyphenyl)-2-methylpentanamide?
The IUPAC name of N-(4-hydroxyphenyl)-2-methylpentanamide (CID 43210200) is N-(4-hydroxyphenyl)-2-methylpentanamide.
What is the SMILES notation for N-(4-hydroxyphenyl)-2-methylpentanamide?
The canonical SMILES for N-(4-hydroxyphenyl)-2-methylpentanamide is CCCC(C)C(=O)Nc1ccc(O)cc1.
What is the InChIKey of N-(4-hydroxyphenyl)-2-methylpentanamide?
The InChIKey is ZXOVWOHUVXPTES-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-3-4-9(2)12(15)13-10-5-7-11(14)8-6-10/h5-9,14H,3-4H2,1-2H3,(H,13,15).
What are the key properties of N-(4-hydroxyphenyl)-2-methylpentanamide?
N-(4-hydroxyphenyl)-2-methylpentanamide has a molecular weight of 207.27 g/mol, XLogP of 2.77, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyphenyl)-2-methylpentanamide is sourced from PubChem (CID 43210200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).