N-(2-chloro-3-hydroxy-4-methylphenyl)acetamide

C9H10ClNO2 — CID 141015549

IUPACN-(2-chloro-3-hydroxy-4-methylphenyl)acetamide
SMILESCC(=O)Nc1ccc(C)c(O)c1Cl
InChIInChI=1S/C9H10ClNO2/c1-5-3-4-7(11-6(2)12)8(10)9(5)13/h3-4,13H,1-2H3,(H,11,12)
InChIKeyUQJOETPBOXMGIR-UHFFFAOYSA-N
MW199.64 g/mol
LogP2.31
Rot. Bonds1

About N-(2-chloro-3-hydroxy-4-methylphenyl)acetamide

N-(2-chloro-3-hydroxy-4-methylphenyl)acetamide (PubChem CID 141015549) has the molecular formula C9H10ClNO2 and a molecular weight of 199.64 g/mol. Its IUPAC name is N-(2-chloro-3-hydroxy-4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(2-chloro-3-hydroxy-4-methylphenyl)acetamide
PubChem CID141015549
Molecular FormulaC9H10ClNO2
Molecular Weight199.64 g/mol
Exact Mass199.04
IUPAC NameN-(2-chloro-3-hydroxy-4-methylphenyl)acetamide
SMILESCC(=O)Nc1ccc(C)c(O)c1Cl
InChIInChI=1S/C9H10ClNO2/c1-5-3-4-7(11-6(2)12)8(10)9(5)13/h3-4,13H,1-2H3,(H,11,12)
InChIKeyUQJOETPBOXMGIR-UHFFFAOYSA-N
XLogP2.31
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.64
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-3-hydroxy-4-methylphenyl)acetamide?
The IUPAC name of N-(2-chloro-3-hydroxy-4-methylphenyl)acetamide (CID 141015549) is N-(2-chloro-3-hydroxy-4-methylphenyl)acetamide.
What is the SMILES notation for N-(2-chloro-3-hydroxy-4-methylphenyl)acetamide?
The canonical SMILES for N-(2-chloro-3-hydroxy-4-methylphenyl)acetamide is CC(=O)Nc1ccc(C)c(O)c1Cl.
What is the InChIKey of N-(2-chloro-3-hydroxy-4-methylphenyl)acetamide?
The InChIKey is UQJOETPBOXMGIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClNO2/c1-5-3-4-7(11-6(2)12)8(10)9(5)13/h3-4,13H,1-2H3,(H,11,12).
What are the key properties of N-(2-chloro-3-hydroxy-4-methylphenyl)acetamide?
N-(2-chloro-3-hydroxy-4-methylphenyl)acetamide has a molecular weight of 199.64 g/mol, XLogP of 2.31, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-3-hydroxy-4-methylphenyl)acetamide is sourced from PubChem (CID 141015549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).