N-(2-ethyl-5-methylsulfanylphenyl)acetamide

C11H15NOS — CID 91881108

IUPACN-(2-ethyl-5-methylsulfanylphenyl)acetamide
SMILESCCc1ccc(SC)cc1NC(C)=O
InChIInChI=1S/C11H15NOS/c1-4-9-5-6-10(14-3)7-11(9)12-8(2)13/h5-7H,4H2,1-3H3,(H,12,13)
InChIKeyHYLVVYGLJBXSJH-UHFFFAOYSA-N
MW209.31 g/mol
LogP2.93
Rot. Bonds3

About N-(2-ethyl-5-methylsulfanylphenyl)acetamide

N-(2-ethyl-5-methylsulfanylphenyl)acetamide (PubChem CID 91881108) has the molecular formula C11H15NOS and a molecular weight of 209.31 g/mol. Its IUPAC name is N-(2-ethyl-5-methylsulfanylphenyl)acetamide.

Molecular Properties

Compound NameN-(2-ethyl-5-methylsulfanylphenyl)acetamide
PubChem CID91881108
Molecular FormulaC11H15NOS
Molecular Weight209.31 g/mol
Exact Mass209.09
IUPAC NameN-(2-ethyl-5-methylsulfanylphenyl)acetamide
SMILESCCc1ccc(SC)cc1NC(C)=O
InChIInChI=1S/C11H15NOS/c1-4-9-5-6-10(14-3)7-11(9)12-8(2)13/h5-7H,4H2,1-3H3,(H,12,13)
InChIKeyHYLVVYGLJBXSJH-UHFFFAOYSA-N
XLogP2.93
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.31
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethyl-5-fluorophenyl)acetamide
CID 143900433
methyl 2-ethyl-5-methylsulfanylbenzoate
CID 91880894
2-bromo-1-ethyl-4-methylsulfanylbenzene
CID 91880744
N-(5-acetamido-2-ethylphenyl)-2-methylpropanamide
CID 110459878
1-(2-chloro-4-methylsulfanylphenyl)propan-2-one
CID 130894787
N-(5-acetamido-2-ethylphenyl)-2-aminoacetamide
CID 39185204
N-(2-ethyl-4-methylphenyl)acetamide
CID 89198969
3-[2-(carboxymethyl)-4-methylsulfanylphenyl]propanoic acid
CID 91881319
1-[2-(bromomethyl)-5-methylsulfanylphenyl]propan-2-one
CID 131527587
N-(2-ethyl-4-methylsulfanylphenyl)formamide
CID 162524929
N-(2-ethylphenyl)-5-methylsulfanyl-2-nitrobenzamide
CID 27895530
N-[3-(2-acetamidoanilino)-4-ethylphenyl]acetamide
CID 163304121

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-5-methylsulfanylphenyl)acetamide?
The IUPAC name of N-(2-ethyl-5-methylsulfanylphenyl)acetamide (CID 91881108) is N-(2-ethyl-5-methylsulfanylphenyl)acetamide.
What is the SMILES notation for N-(2-ethyl-5-methylsulfanylphenyl)acetamide?
The canonical SMILES for N-(2-ethyl-5-methylsulfanylphenyl)acetamide is CCc1ccc(SC)cc1NC(C)=O.
What is the InChIKey of N-(2-ethyl-5-methylsulfanylphenyl)acetamide?
The InChIKey is HYLVVYGLJBXSJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NOS/c1-4-9-5-6-10(14-3)7-11(9)12-8(2)13/h5-7H,4H2,1-3H3,(H,12,13).
What are the key properties of N-(2-ethyl-5-methylsulfanylphenyl)acetamide?
N-(2-ethyl-5-methylsulfanylphenyl)acetamide has a molecular weight of 209.31 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-5-methylsulfanylphenyl)acetamide is sourced from PubChem (CID 91881108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).