N-(4-methyl-2-methylsulfanylphenyl)acetamide

C10H13NOS — CID 150467618

IUPACN-(4-methyl-2-methylsulfanylphenyl)acetamide
SMILESCSc1cc(C)ccc1NC(C)=O
InChIInChI=1S/C10H13NOS/c1-7-4-5-9(11-8(2)12)10(6-7)13-3/h4-6H,1-3H3,(H,11,12)
InChIKeyHRCUYHLLHOHCML-UHFFFAOYSA-N
MW195.29 g/mol
LogP2.68
Rot. Bonds2

About N-(4-methyl-2-methylsulfanylphenyl)acetamide

N-(4-methyl-2-methylsulfanylphenyl)acetamide (PubChem CID 150467618) has the molecular formula C10H13NOS and a molecular weight of 195.29 g/mol. Its IUPAC name is N-(4-methyl-2-methylsulfanylphenyl)acetamide.

Molecular Properties

Compound NameN-(4-methyl-2-methylsulfanylphenyl)acetamide
PubChem CID150467618
Molecular FormulaC10H13NOS
Molecular Weight195.29 g/mol
Exact Mass195.07
IUPAC NameN-(4-methyl-2-methylsulfanylphenyl)acetamide
SMILESCSc1cc(C)ccc1NC(C)=O
InChIInChI=1S/C10H13NOS/c1-7-4-5-9(11-8(2)12)10(6-7)13-3/h4-6H,1-3H3,(H,11,12)
InChIKeyHRCUYHLLHOHCML-UHFFFAOYSA-N
XLogP2.68
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.29
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2-methylsulfanylphenyl)acetamide?
The IUPAC name of N-(4-methyl-2-methylsulfanylphenyl)acetamide (CID 150467618) is N-(4-methyl-2-methylsulfanylphenyl)acetamide.
What is the SMILES notation for N-(4-methyl-2-methylsulfanylphenyl)acetamide?
The canonical SMILES for N-(4-methyl-2-methylsulfanylphenyl)acetamide is CSc1cc(C)ccc1NC(C)=O.
What is the InChIKey of N-(4-methyl-2-methylsulfanylphenyl)acetamide?
The InChIKey is HRCUYHLLHOHCML-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NOS/c1-7-4-5-9(11-8(2)12)10(6-7)13-3/h4-6H,1-3H3,(H,11,12).
What are the key properties of N-(4-methyl-2-methylsulfanylphenyl)acetamide?
N-(4-methyl-2-methylsulfanylphenyl)acetamide has a molecular weight of 195.29 g/mol, XLogP of 2.68, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2-methylsulfanylphenyl)acetamide is sourced from PubChem (CID 150467618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).