2-(3-chlorophenyl)-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide

C17H18ClNO2 — CID 105059159

IUPAC2-(3-chlorophenyl)-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide
SMILESCC(CO)(NC(=O)Cc1cccc(Cl)c1)c1ccccc1
InChIInChI=1S/C17H18ClNO2/c1-17(12-20,14-7-3-2-4-8-14)19-16(21)11-13-6-5-9-15(18)10-13/h2-10,20H,11-12H2,1H3,(H,19,21)
InChIKeyBNAOVEFINRZRKT-UHFFFAOYSA-N
MW303.79 g/mol
LogP2.91
Rot. Bonds5

About 2-(3-chlorophenyl)-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide

2-(3-chlorophenyl)-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide (PubChem CID 105059159) has the molecular formula C17H18ClNO2 and a molecular weight of 303.79 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide.

Molecular Properties

Compound Name2-(3-chlorophenyl)-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide
PubChem CID105059159
Molecular FormulaC17H18ClNO2
Molecular Weight303.79 g/mol
Exact Mass303.10
IUPAC Name2-(3-chlorophenyl)-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide
SMILESCC(CO)(NC(=O)Cc1cccc(Cl)c1)c1ccccc1
InChIInChI=1S/C17H18ClNO2/c1-17(12-20,14-7-3-2-4-8-14)19-16(21)11-13-6-5-9-15(18)10-13/h2-10,20H,11-12H2,1H3,(H,19,21)
InChIKeyBNAOVEFINRZRKT-UHFFFAOYSA-N
XLogP2.91
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.79
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-chlorophenyl)-N-(2-phenylpropan-2-yl)acetamide
CID 13118326
2-(3-chlorophenyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide
CID 62504626
2-(3-chlorophenyl)-N-(2-naphthalen-2-ylpropan-2-yl)acetamide
CID 15590855
N-(1-hydroxy-2-phenylpropan-2-yl)-2-pyridin-4-ylacetamide
CID 105059171
3-[[2-(3-chlorophenyl)acetyl]amino]-2,2,3-trimethylbutanoic acid
CID 65261502
N-(1-hydroxy-2-phenylpropan-2-yl)propanamide
CID 105058812
N-(1-amino-2-methyl-1-sulfanylidenepropan-2-yl)-2-(3-chlorophenyl)acetamide
CID 62503915
3-amino-N-(1-hydroxy-2-phenylpropan-2-yl)propanamide
CID 105058260
2-(3-hydroxyphenyl)-N-(1-methoxy-2-phenylpropan-2-yl)acetamide
CID 75518765
3-bromo-N-(1-hydroxy-2-phenylpropan-2-yl)propanamide
CID 105057894
1-(3-chlorophenyl)-3,3-dimethylbutan-2-one
CID 59128725
(1-hydroxy-2-phenylpropan-2-yl)urea
CID 105059189

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide?
The IUPAC name of 2-(3-chlorophenyl)-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide (CID 105059159) is 2-(3-chlorophenyl)-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide.
What is the SMILES notation for 2-(3-chlorophenyl)-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide?
The canonical SMILES for 2-(3-chlorophenyl)-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide is CC(CO)(NC(=O)Cc1cccc(Cl)c1)c1ccccc1.
What is the InChIKey of 2-(3-chlorophenyl)-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide?
The InChIKey is BNAOVEFINRZRKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClNO2/c1-17(12-20,14-7-3-2-4-8-14)19-16(21)11-13-6-5-9-15(18)10-13/h2-10,20H,11-12H2,1H3,(H,19,21).
What are the key properties of 2-(3-chlorophenyl)-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide?
2-(3-chlorophenyl)-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide has a molecular weight of 303.79 g/mol, XLogP of 2.91, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide is sourced from PubChem (CID 105059159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).