N-carbamoyl-2-(4-methylphenyl)sulfanylacetamide

C10H12N2O2S — CID 8752877

IUPACN-carbamoyl-2-(4-methylphenyl)sulfanylacetamide
SMILESCc1ccc(SCC(=O)NC(N)=O)cc1
InChIInChI=1S/C10H12N2O2S/c1-7-2-4-8(5-3-7)15-6-9(13)12-10(11)14/h2-5H,6H2,1H3,(H3,11,12,13,14)
InChIKeyRTBFBSKOAYITGF-UHFFFAOYSA-N
MW224.28 g/mol
LogP1.28
Rot. Bonds3

About N-carbamoyl-2-(4-methylphenyl)sulfanylacetamide

N-carbamoyl-2-(4-methylphenyl)sulfanylacetamide (PubChem CID 8752877) has the molecular formula C10H12N2O2S and a molecular weight of 224.28 g/mol. Its IUPAC name is N-carbamoyl-2-(4-methylphenyl)sulfanylacetamide.

Molecular Properties

Compound NameN-carbamoyl-2-(4-methylphenyl)sulfanylacetamide
PubChem CID8752877
Molecular FormulaC10H12N2O2S
Molecular Weight224.28 g/mol
Exact Mass224.06
IUPAC NameN-carbamoyl-2-(4-methylphenyl)sulfanylacetamide
SMILESCc1ccc(SCC(=O)NC(N)=O)cc1
InChIInChI=1S/C10H12N2O2S/c1-7-2-4-8(5-3-7)15-6-9(13)12-10(11)14/h2-5H,6H2,1H3,(H3,11,12,13,14)
InChIKeyRTBFBSKOAYITGF-UHFFFAOYSA-N
XLogP1.28
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.28
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-carbamoyl-2-(4-methylphenyl)sulfanylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-amino-2-methylpropyl)-2-(4-methylphenyl)sulfanylacetamide;hydrochloride
CID 119625677
N'-acetyl-2-(4-methylphenyl)sulfanylacetohydrazide
CID 17394299
[1-(4-methylphenyl)sulfanylpropan-2-ylideneamino]urea
CID 71406398
N'-[2-(4-fluorophenyl)sulfanylacetyl]-2-(4-methylphenyl)sulfanylacetohydrazide
CID 7970067
N-[4-[2-(4-carbamoylanilino)-2-oxoethyl]sulfanylphenyl]-4-methylbenzamide
CID 22777218
ethyl 4-[[2-(4-methylphenyl)sulfanylacetyl]amino]butanoate
CID 60625103
2-(4-methylphenyl)sulfanyl-N-(2,2,2-trifluoroethoxy)acetamide
CID 81341154
3-(4-methylphenyl)sulfanylprop-1-en-2-amine
CID 143815010
2-[2-[[2-(4-methylphenyl)sulfanylacetyl]amino]phenyl]sulfanylacetamide
CID 27015578
N-[2-[[2-(4-methylphenyl)sulfanylacetyl]amino]phenyl]butanamide
CID 974708
N-(4-fluorophenyl)-2-(4-methylphenyl)sulfanylacetamide
CID 2824699
3-[[2-(4-methylphenyl)sulfanylacetyl]amino]butanoic acid
CID 43240777

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-(4-methylphenyl)sulfanylacetamide?
The IUPAC name of N-carbamoyl-2-(4-methylphenyl)sulfanylacetamide (CID 8752877) is N-carbamoyl-2-(4-methylphenyl)sulfanylacetamide.
What is the SMILES notation for N-carbamoyl-2-(4-methylphenyl)sulfanylacetamide?
The canonical SMILES for N-carbamoyl-2-(4-methylphenyl)sulfanylacetamide is Cc1ccc(SCC(=O)NC(N)=O)cc1.
What is the InChIKey of N-carbamoyl-2-(4-methylphenyl)sulfanylacetamide?
The InChIKey is RTBFBSKOAYITGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2S/c1-7-2-4-8(5-3-7)15-6-9(13)12-10(11)14/h2-5H,6H2,1H3,(H3,11,12,13,14).
What are the key properties of N-carbamoyl-2-(4-methylphenyl)sulfanylacetamide?
N-carbamoyl-2-(4-methylphenyl)sulfanylacetamide has a molecular weight of 224.28 g/mol, XLogP of 1.28, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-(4-methylphenyl)sulfanylacetamide is sourced from PubChem (CID 8752877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).