2-cyclopent-2-en-1-yl-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide

C16H21NO2 — CID 105058863

IUPAC2-cyclopent-2-en-1-yl-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide
SMILESCC(CO)(NC(=O)CC1C=CCC1)c1ccccc1
InChIInChI=1S/C16H21NO2/c1-16(12-18,14-9-3-2-4-10-14)17-15(19)11-13-7-5-6-8-13/h2-5,7,9-10,13,18H,6,8,11-12H2,1H3,(H,17,19)
InChIKeyGWHXZCXRCSOSDM-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.37
Rot. Bonds5

About 2-cyclopent-2-en-1-yl-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide

2-cyclopent-2-en-1-yl-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide (PubChem CID 105058863) has the molecular formula C16H21NO2 and a molecular weight of 259.35 g/mol. Its IUPAC name is 2-cyclopent-2-en-1-yl-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide.

Molecular Properties

Compound Name2-cyclopent-2-en-1-yl-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide
PubChem CID105058863
Molecular FormulaC16H21NO2
Molecular Weight259.35 g/mol
Exact Mass259.16
IUPAC Name2-cyclopent-2-en-1-yl-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide
SMILESCC(CO)(NC(=O)CC1C=CCC1)c1ccccc1
InChIInChI=1S/C16H21NO2/c1-16(12-18,14-9-3-2-4-10-14)17-15(19)11-13-7-5-6-8-13/h2-5,7,9-10,13,18H,6,8,11-12H2,1H3,(H,17,19)
InChIKeyGWHXZCXRCSOSDM-UHFFFAOYSA-N
XLogP2.37
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-cyclohexyl-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide
CID 105058964
N-(1-hydroxy-2-phenylpropan-2-yl)propanamide
CID 105058812
2-cyclopent-2-en-1-yl-N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]acetamide
CID 103604609
3-amino-N-(1-hydroxy-2-phenylpropan-2-yl)propanamide
CID 105058260
3-bromo-N-(1-hydroxy-2-phenylpropan-2-yl)propanamide
CID 105057894
(1-hydroxy-2-phenylpropan-2-yl)urea
CID 105059189
N-(1-amino-2,3-dimethylbutan-2-yl)-2-cyclopent-2-en-1-ylacetamide
CID 115310441
N-[2-[(2-cyclopent-2-en-1-ylacetyl)amino]phenyl]-3,4,4-trimethylpentanamide
CID 86901395
2-[(1R)-cyclohex-2-en-1-yl]-N-phenylacetamide
CID 102462286
2-cyclopent-2-en-1-yl-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]acetamide
CID 56793632
2-[(1S)-cyclopent-2-en-1-yl]-N-(2-methylsulfonylphenyl)acetamide
CID 51929140
2-[(2-cyclopent-2-en-1-ylacetyl)amino]propanoic acid
CID 24696738

Frequently Asked Questions

What is the IUPAC name of 2-cyclopent-2-en-1-yl-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide?
The IUPAC name of 2-cyclopent-2-en-1-yl-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide (CID 105058863) is 2-cyclopent-2-en-1-yl-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide.
What is the SMILES notation for 2-cyclopent-2-en-1-yl-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide?
The canonical SMILES for 2-cyclopent-2-en-1-yl-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide is CC(CO)(NC(=O)CC1C=CCC1)c1ccccc1.
What is the InChIKey of 2-cyclopent-2-en-1-yl-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide?
The InChIKey is GWHXZCXRCSOSDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO2/c1-16(12-18,14-9-3-2-4-10-14)17-15(19)11-13-7-5-6-8-13/h2-5,7,9-10,13,18H,6,8,11-12H2,1H3,(H,17,19).
What are the key properties of 2-cyclopent-2-en-1-yl-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide?
2-cyclopent-2-en-1-yl-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide has a molecular weight of 259.35 g/mol, XLogP of 2.37, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopent-2-en-1-yl-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide is sourced from PubChem (CID 105058863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).