2-(3-chlorophenyl)-N-(2-hydroxy-2,4-dimethylpentyl)acetamide

C15H22ClNO2 — CID 66178729

IUPAC2-(3-chlorophenyl)-N-(2-hydroxy-2,4-dimethylpentyl)acetamide
SMILESCC(C)CC(C)(O)CNC(=O)Cc1cccc(Cl)c1
InChIInChI=1S/C15H22ClNO2/c1-11(2)9-15(3,19)10-17-14(18)8-12-5-4-6-13(16)7-12/h4-7,11,19H,8-10H2,1-3H3,(H,17,18)
InChIKeyBILYFWGTXFOQIQ-UHFFFAOYSA-N
MW283.80 g/mol
LogP2.80
Rot. Bonds6

About 2-(3-chlorophenyl)-N-(2-hydroxy-2,4-dimethylpentyl)acetamide

2-(3-chlorophenyl)-N-(2-hydroxy-2,4-dimethylpentyl)acetamide (PubChem CID 66178729) has the molecular formula C15H22ClNO2 and a molecular weight of 283.80 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-N-(2-hydroxy-2,4-dimethylpentyl)acetamide.

Molecular Properties

Compound Name2-(3-chlorophenyl)-N-(2-hydroxy-2,4-dimethylpentyl)acetamide
PubChem CID66178729
Molecular FormulaC15H22ClNO2
Molecular Weight283.80 g/mol
Exact Mass283.13
IUPAC Name2-(3-chlorophenyl)-N-(2-hydroxy-2,4-dimethylpentyl)acetamide
SMILESCC(C)CC(C)(O)CNC(=O)Cc1cccc(Cl)c1
InChIInChI=1S/C15H22ClNO2/c1-11(2)9-15(3,19)10-17-14(18)8-12-5-4-6-13(16)7-12/h4-7,11,19H,8-10H2,1-3H3,(H,17,18)
InChIKeyBILYFWGTXFOQIQ-UHFFFAOYSA-N
XLogP2.80
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.80
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-hydroxy-2,4-dimethylpentyl)-2-pyridin-3-ylacetamide
CID 66178919
N-(4-bromo-2,2-dimethylbutyl)-2-(3-chlorophenyl)acetamide
CID 106143575
2-[2-(aminomethyl)phenyl]-N-(2-hydroxy-2,4-dimethylpentyl)acetamide
CID 81322635
2-phenyl-N-(2,2,4-trimethylpentyl)acetamide
CID 165399012
N-(3-amino-2-methyl-3-sulfanylidenepropyl)-2-(3-chlorophenyl)acetamide
CID 62668200
2-(3-chlorophenyl)-N-(4-hydroxy-2-methylpentyl)acetamide
CID 111447713
N-(2-hydroxy-2,4-dimethylpentyl)-2-methylpropanamide
CID 66180454
N-(2,3-dihydroxy-2-methylpropyl)-2-(3-hydroxyphenyl)acetamide
CID 66169594
3-bromo-N-(2-hydroxy-2,4-dimethylpentyl)benzamide
CID 66179359
2-(3-chlorophenyl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide
CID 62504626
1-(3-chlorophenyl)-3,3-dimethylbutan-2-one
CID 59128725
2-amino-N-[3-(3-chlorophenyl)-2,2-dimethylpropyl]acetamide
CID 119339868

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-N-(2-hydroxy-2,4-dimethylpentyl)acetamide?
The IUPAC name of 2-(3-chlorophenyl)-N-(2-hydroxy-2,4-dimethylpentyl)acetamide (CID 66178729) is 2-(3-chlorophenyl)-N-(2-hydroxy-2,4-dimethylpentyl)acetamide.
What is the SMILES notation for 2-(3-chlorophenyl)-N-(2-hydroxy-2,4-dimethylpentyl)acetamide?
The canonical SMILES for 2-(3-chlorophenyl)-N-(2-hydroxy-2,4-dimethylpentyl)acetamide is CC(C)CC(C)(O)CNC(=O)Cc1cccc(Cl)c1.
What is the InChIKey of 2-(3-chlorophenyl)-N-(2-hydroxy-2,4-dimethylpentyl)acetamide?
The InChIKey is BILYFWGTXFOQIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClNO2/c1-11(2)9-15(3,19)10-17-14(18)8-12-5-4-6-13(16)7-12/h4-7,11,19H,8-10H2,1-3H3,(H,17,18).
What are the key properties of 2-(3-chlorophenyl)-N-(2-hydroxy-2,4-dimethylpentyl)acetamide?
2-(3-chlorophenyl)-N-(2-hydroxy-2,4-dimethylpentyl)acetamide has a molecular weight of 283.80 g/mol, XLogP of 2.80, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-N-(2-hydroxy-2,4-dimethylpentyl)acetamide is sourced from PubChem (CID 66178729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).