2-hydroxy-2-[3-(4-phenylbutyl)phenyl]acetamide

C18H21NO2 — CID 89454615

IUPAC2-hydroxy-2-[3-(4-phenylbutyl)phenyl]acetamide
SMILESNC(=O)C(O)c1cccc(CCCCc2ccccc2)c1
InChIInChI=1S/C18H21NO2/c19-18(21)17(20)16-12-6-11-15(13-16)10-5-4-9-14-7-2-1-3-8-14/h1-3,6-8,11-13,17,20H,4-5,9-10H2,(H2,19,21)
InChIKeyAKZJXVMRXHDIRV-UHFFFAOYSA-N
MW283.37 g/mol
LogP2.77
Rot. Bonds7

About 2-hydroxy-2-[3-(4-phenylbutyl)phenyl]acetamide

2-hydroxy-2-[3-(4-phenylbutyl)phenyl]acetamide (PubChem CID 89454615) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is 2-hydroxy-2-[3-(4-phenylbutyl)phenyl]acetamide.

Molecular Properties

Compound Name2-hydroxy-2-[3-(4-phenylbutyl)phenyl]acetamide
PubChem CID89454615
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC Name2-hydroxy-2-[3-(4-phenylbutyl)phenyl]acetamide
SMILESNC(=O)C(O)c1cccc(CCCCc2ccccc2)c1
InChIInChI=1S/C18H21NO2/c19-18(21)17(20)16-12-6-11-15(13-16)10-5-4-9-14-7-2-1-3-8-14/h1-3,6-8,11-13,17,20H,4-5,9-10H2,(H2,19,21)
InChIKeyAKZJXVMRXHDIRV-UHFFFAOYSA-N
XLogP2.77
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-hydroxy-2-[3-(4-phenylbutyl)phenyl]acetamide 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

2-hydroxy-2-phenylacetamide;hydrochloride
CID 67718904
2-hydroxy-8-phenyloctanamide
CID 66822616
(2R)-2-(3-aminophenyl)-2-hydroxyacetamide
CID 129410054
8-phenyloctyl carbamate
CID 67180735
methyl 2-hydroxy-2-[3-(2-methoxyethyl)phenyl]acetate
CID 117108625
28-[3-(28-amino-28-oxooctacosyl)phenyl]octacosanamide
CID 139913046
3-[3-[1-(dimethylamino)ethyl]phenyl]propyl carbamate
CID 91318489
2-hydroxy-2-[3-(hydroxymethyl)phenyl]-1-phenylethanone
CID 70540127
4-phenylbutylbenzene
CID 141301927
(2R)-2-hydroxy-2-naphthalen-2-ylacetamide
CID 11356121
4-ethylaniline;2-hydroxy-2-phenylacetamide
CID 145017950
(1R)-1,4-diphenylbutan-1-amine
CID 7131342

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-[3-(4-phenylbutyl)phenyl]acetamide?
The IUPAC name of 2-hydroxy-2-[3-(4-phenylbutyl)phenyl]acetamide (CID 89454615) is 2-hydroxy-2-[3-(4-phenylbutyl)phenyl]acetamide.
What is the SMILES notation for 2-hydroxy-2-[3-(4-phenylbutyl)phenyl]acetamide?
The canonical SMILES for 2-hydroxy-2-[3-(4-phenylbutyl)phenyl]acetamide is NC(=O)C(O)c1cccc(CCCCc2ccccc2)c1.
What is the InChIKey of 2-hydroxy-2-[3-(4-phenylbutyl)phenyl]acetamide?
The InChIKey is AKZJXVMRXHDIRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c19-18(21)17(20)16-12-6-11-15(13-16)10-5-4-9-14-7-2-1-3-8-14/h1-3,6-8,11-13,17,20H,4-5,9-10H2,(H2,19,21).
What are the key properties of 2-hydroxy-2-[3-(4-phenylbutyl)phenyl]acetamide?
2-hydroxy-2-[3-(4-phenylbutyl)phenyl]acetamide has a molecular weight of 283.37 g/mol, XLogP of 2.77, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-[3-(4-phenylbutyl)phenyl]acetamide is sourced from PubChem (CID 89454615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).