2-(4-chlorophenyl)-N-(3-hydroxy-2-methylbutan-2-yl)acetamide

C13H18ClNO2 — CID 115884674

IUPAC2-(4-chlorophenyl)-N-(3-hydroxy-2-methylbutan-2-yl)acetamide
SMILESCC(O)C(C)(C)NC(=O)Cc1ccc(Cl)cc1
InChIInChI=1S/C13H18ClNO2/c1-9(16)13(2,3)15-12(17)8-10-4-6-11(14)7-5-10/h4-7,9,16H,8H2,1-3H3,(H,15,17)
InChIKeyUILLFTXVGWUCTO-UHFFFAOYSA-N
MW255.74 g/mol
LogP2.16
Rot. Bonds4

About 2-(4-chlorophenyl)-N-(3-hydroxy-2-methylbutan-2-yl)acetamide

2-(4-chlorophenyl)-N-(3-hydroxy-2-methylbutan-2-yl)acetamide (PubChem CID 115884674) has the molecular formula C13H18ClNO2 and a molecular weight of 255.74 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-(3-hydroxy-2-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-(3-hydroxy-2-methylbutan-2-yl)acetamide
PubChem CID115884674
Molecular FormulaC13H18ClNO2
Molecular Weight255.74 g/mol
Exact Mass255.10
IUPAC Name2-(4-chlorophenyl)-N-(3-hydroxy-2-methylbutan-2-yl)acetamide
SMILESCC(O)C(C)(C)NC(=O)Cc1ccc(Cl)cc1
InChIInChI=1S/C13H18ClNO2/c1-9(16)13(2,3)15-12(17)8-10-4-6-11(14)7-5-10/h4-7,9,16H,8H2,1-3H3,(H,15,17)
InChIKeyUILLFTXVGWUCTO-UHFFFAOYSA-N
XLogP2.16
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.74
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-ethoxyphenyl)-N-(3-hydroxy-2-methylbutan-2-yl)acetamide
CID 115884327
N-tert-butyl-2-[4-(4-chlorophenyl)phenyl]acetamide
CID 59659873
2-(4-chlorophenyl)-N-[(2R)-3,3-dimethylbutan-2-yl]acetamide
CID 42561774
2-(4-chlorophenyl)-N-(2-cyano-3,3-dimethylbutan-2-yl)acetamide
CID 15457246
methyl 2-[[2-(4-chlorophenyl)acetyl]amino]propanoate
CID 60638078
2-(4-chlorophenyl)-N-[3-(hydroxymethyl)pentan-3-yl]acetamide
CID 62520281
2-(4-chlorophenyl)-N-(3-methylpent-1-yn-3-yl)acetamide
CID 4303275
2-chloro-N-[2-(4-chlorophenyl)acetyl]propanamide
CID 163857832
2-(4-chlorophenyl)-N-[(1R)-1-(4-chlorophenyl)ethyl]acetamide
CID 8751569
2-(4-chlorophenyl)-N-(2-hydroxy-2-methylpropyl)acetamide
CID 65110146
2-(4-chlorophenyl)-N-[2-(4-methoxyphenyl)propan-2-yl]acetamide
CID 113091682
N-(1-amino-2-cyclopropylpropan-2-yl)-2-(4-chlorophenyl)acetamide
CID 81487152

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-(3-hydroxy-2-methylbutan-2-yl)acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-(3-hydroxy-2-methylbutan-2-yl)acetamide (CID 115884674) is 2-(4-chlorophenyl)-N-(3-hydroxy-2-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-(3-hydroxy-2-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-(3-hydroxy-2-methylbutan-2-yl)acetamide is CC(O)C(C)(C)NC(=O)Cc1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-N-(3-hydroxy-2-methylbutan-2-yl)acetamide?
The InChIKey is UILLFTXVGWUCTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClNO2/c1-9(16)13(2,3)15-12(17)8-10-4-6-11(14)7-5-10/h4-7,9,16H,8H2,1-3H3,(H,15,17).
What are the key properties of 2-(4-chlorophenyl)-N-(3-hydroxy-2-methylbutan-2-yl)acetamide?
2-(4-chlorophenyl)-N-(3-hydroxy-2-methylbutan-2-yl)acetamide has a molecular weight of 255.74 g/mol, XLogP of 2.16, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-(3-hydroxy-2-methylbutan-2-yl)acetamide is sourced from PubChem (CID 115884674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).