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

C10H13NOS — CID 12915123

IUPACN-methyl-N-(4-methylsulfanylphenyl)acetamide
SMILESCSc1ccc(N(C)C(C)=O)cc1
InChIInChI=1S/C10H13NOS/c1-8(12)11(2)9-4-6-10(13-3)7-5-9/h4-7H,1-3H3
InChIKeyAVNSUSUWWKYSHX-UHFFFAOYSA-N
MW195.29 g/mol
LogP2.39
Rot. Bonds2

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

N-methyl-N-(4-methylsulfanylphenyl)acetamide (PubChem CID 12915123) has the molecular formula C10H13NOS and a molecular weight of 195.29 g/mol. Its IUPAC name is N-methyl-N-(4-methylsulfanylphenyl)acetamide.

Molecular Properties

Compound NameN-methyl-N-(4-methylsulfanylphenyl)acetamide
PubChem CID12915123
Molecular FormulaC10H13NOS
Molecular Weight195.29 g/mol
Exact Mass195.07
IUPAC NameN-methyl-N-(4-methylsulfanylphenyl)acetamide
SMILESCSc1ccc(N(C)C(C)=O)cc1
InChIInChI=1S/C10H13NOS/c1-8(12)11(2)9-4-6-10(13-3)7-5-9/h4-7H,1-3H3
InChIKeyAVNSUSUWWKYSHX-UHFFFAOYSA-N
XLogP2.39
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.29
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl N-methyl-N-(4-methylsulfanylphenyl)carbamate
CID 173195288
N-(4-hydroxyphenyl)-N-methyl-4-methylsulfanylbenzamide
CID 112726419
(2R)-2-amino-N-methyl-N-(4-methylsulfanylphenyl)propanamide;hydrochloride
CID 119320848
4-(N-methyl-4-methylsulfanylanilino)-4-oxobutanoic acid
CID 54320412
ethane;N-methyl-N-(4-methylphenyl)acetamide
CID 143974566
2-cyano-N-methyl-N-(4-methylsulfanylphenyl)acetamide
CID 115173017
2-amino-3-hydroxy-N-methyl-N-(4-methylsulfanylphenyl)propanamide
CID 115179752
2-[methyl-(4-methylsulfanylphenyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 115165374
N-[4-[acetyl(methyl)amino]phenyl]-2-methoxy-4-methylsulfanylbenzamide
CID 670804
ethyl 3-(N-methyl-4-methylsulfanylanilino)-3-oxopropanoate
CID 115138514
1-amino-N-methyl-N-(4-methylsulfanylphenyl)cyclohexane-1-carboxamide
CID 119320851
N-[4-[acetyl(methyl)amino]phenyl]-4-fluoro-N-methylbenzamide
CID 113094823

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(4-methylsulfanylphenyl)acetamide?
The IUPAC name of N-methyl-N-(4-methylsulfanylphenyl)acetamide (CID 12915123) is N-methyl-N-(4-methylsulfanylphenyl)acetamide.
What is the SMILES notation for N-methyl-N-(4-methylsulfanylphenyl)acetamide?
The canonical SMILES for N-methyl-N-(4-methylsulfanylphenyl)acetamide is CSc1ccc(N(C)C(C)=O)cc1.
What is the InChIKey of N-methyl-N-(4-methylsulfanylphenyl)acetamide?
The InChIKey is AVNSUSUWWKYSHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NOS/c1-8(12)11(2)9-4-6-10(13-3)7-5-9/h4-7H,1-3H3.
What are the key properties of N-methyl-N-(4-methylsulfanylphenyl)acetamide?
N-methyl-N-(4-methylsulfanylphenyl)acetamide has a molecular weight of 195.29 g/mol, XLogP of 2.39, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(4-methylsulfanylphenyl)acetamide is sourced from PubChem (CID 12915123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).