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

C9H10ClNO — CID 23537

IUPACN-(3-chloro-4-methylphenyl)acetamide
SMILESCC(=O)Nc1ccc(C)c(Cl)c1
InChIInChI=1S/C9H10ClNO/c1-6-3-4-8(5-9(6)10)11-7(2)12/h3-5H,1-2H3,(H,11,12)
InChIKeyIGLVCWPPISIXPR-UHFFFAOYSA-N
MW183.64 g/mol
LogP2.61
Rot. Bonds1

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

N-(3-chloro-4-methylphenyl)acetamide (PubChem CID 23537) has the molecular formula C9H10ClNO and a molecular weight of 183.64 g/mol. Its IUPAC name is N-(3-chloro-4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(3-chloro-4-methylphenyl)acetamide
PubChem CID23537
Molecular FormulaC9H10ClNO
Molecular Weight183.64 g/mol
Exact Mass183.05
IUPAC NameN-(3-chloro-4-methylphenyl)acetamide
SMILESCC(=O)Nc1ccc(C)c(Cl)c1
InChIInChI=1S/C9H10ClNO/c1-6-3-4-8(5-9(6)10)11-7(2)12/h3-5H,1-2H3,(H,11,12)
InChIKeyIGLVCWPPISIXPR-UHFFFAOYSA-N
XLogP2.61
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.64
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methylphenyl)acetamide?
The IUPAC name of N-(3-chloro-4-methylphenyl)acetamide (CID 23537) is N-(3-chloro-4-methylphenyl)acetamide.
What is the SMILES notation for N-(3-chloro-4-methylphenyl)acetamide?
The canonical SMILES for N-(3-chloro-4-methylphenyl)acetamide is CC(=O)Nc1ccc(C)c(Cl)c1.
What is the InChIKey of N-(3-chloro-4-methylphenyl)acetamide?
The InChIKey is IGLVCWPPISIXPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClNO/c1-6-3-4-8(5-9(6)10)11-7(2)12/h3-5H,1-2H3,(H,11,12).
What are the key properties of N-(3-chloro-4-methylphenyl)acetamide?
N-(3-chloro-4-methylphenyl)acetamide has a molecular weight of 183.64 g/mol, XLogP of 2.61, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methylphenyl)acetamide is sourced from PubChem (CID 23537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).