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

C12H16ClNO2 — CID 62504626

IUPAC2-(3-chlorophenyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide
SMILESCC(C)(CO)NC(=O)Cc1cccc(Cl)c1
InChIInChI=1S/C12H16ClNO2/c1-12(2,8-15)14-11(16)7-9-4-3-5-10(13)6-9/h3-6,15H,7-8H2,1-2H3,(H,14,16)
InChIKeyFJJDWNWLMBJHDY-UHFFFAOYSA-N
MW241.72 g/mol
LogP1.77
Rot. Bonds4

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

2-(3-chlorophenyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide (PubChem CID 62504626) has the molecular formula C12H16ClNO2 and a molecular weight of 241.72 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide.

Molecular Properties

Compound Name2-(3-chlorophenyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide
PubChem CID62504626
Molecular FormulaC12H16ClNO2
Molecular Weight241.72 g/mol
Exact Mass241.09
IUPAC Name2-(3-chlorophenyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide
SMILESCC(C)(CO)NC(=O)Cc1cccc(Cl)c1
InChIInChI=1S/C12H16ClNO2/c1-12(2,8-15)14-11(16)7-9-4-3-5-10(13)6-9/h3-6,15H,7-8H2,1-2H3,(H,14,16)
InChIKeyFJJDWNWLMBJHDY-UHFFFAOYSA-N
XLogP1.77
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.72
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-chlorophenyl)-N-(1-hydroxy-2-phenylpropan-2-yl)acetamide
CID 105059159
3-[[2-(3-chlorophenyl)acetyl]amino]-2,2,3-trimethylbutanoic acid
CID 65261502
2-(3-chlorophenyl)-N-(2-phenylpropan-2-yl)acetamide
CID 13118326
1-(3-chlorophenyl)-3,3-dimethylbutan-2-one
CID 59128725
2-chloro-N-[4-(3-chlorophenyl)-2-methylbutan-2-yl]acetamide
CID 94698283
N-(1-amino-2-methyl-1-sulfanylidenepropan-2-yl)-2-(3-chlorophenyl)acetamide
CID 62503915
2-(3-chlorophenyl)-N-(2-naphthalen-2-ylpropan-2-yl)acetamide
CID 15590855
1-(3-chlorophenyl)propan-2-one
CID 2734097
2-(3-chlorophenyl)-N-(methylcarbamothioyl)acetamide
CID 143657738
N-(4-bromo-2,2-dimethylbutyl)-2-(3-chlorophenyl)acetamide
CID 106143575
N-tert-butyl-2-[(3-chlorophenyl)methylamino]acetamide
CID 55024120
N-(4-bromocyclohexyl)-2-(3-chlorophenyl)acetamide
CID 113274232

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide?
The IUPAC name of 2-(3-chlorophenyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide (CID 62504626) is 2-(3-chlorophenyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide.
What is the SMILES notation for 2-(3-chlorophenyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide?
The canonical SMILES for 2-(3-chlorophenyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide is CC(C)(CO)NC(=O)Cc1cccc(Cl)c1.
What is the InChIKey of 2-(3-chlorophenyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide?
The InChIKey is FJJDWNWLMBJHDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClNO2/c1-12(2,8-15)14-11(16)7-9-4-3-5-10(13)6-9/h3-6,15H,7-8H2,1-2H3,(H,14,16).
What are the key properties of 2-(3-chlorophenyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide?
2-(3-chlorophenyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide has a molecular weight of 241.72 g/mol, XLogP of 1.77, 4 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-methylpropan-2-yl)acetamide is sourced from PubChem (CID 62504626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).