N-(ethylcarbamoyl)-2-(2-fluorophenyl)sulfanylacetamide

C11H13FN2O2S — CID 2591666

IUPACN-(ethylcarbamoyl)-2-(2-fluorophenyl)sulfanylacetamide
SMILESCCNC(=O)NC(=O)CSc1ccccc1F
InChIInChI=1S/C11H13FN2O2S/c1-2-13-11(16)14-10(15)7-17-9-6-4-3-5-8(9)12/h3-6H,2,7H2,1H3,(H2,13,14,15,16)
InChIKeyUTYZFTZBJUVUNL-UHFFFAOYSA-N
MW256.30 g/mol
LogP1.76
Rot. Bonds4

About N-(ethylcarbamoyl)-2-(2-fluorophenyl)sulfanylacetamide

N-(ethylcarbamoyl)-2-(2-fluorophenyl)sulfanylacetamide (PubChem CID 2591666) has the molecular formula C11H13FN2O2S and a molecular weight of 256.30 g/mol. Its IUPAC name is N-(ethylcarbamoyl)-2-(2-fluorophenyl)sulfanylacetamide.

Molecular Properties

Compound NameN-(ethylcarbamoyl)-2-(2-fluorophenyl)sulfanylacetamide
PubChem CID2591666
Molecular FormulaC11H13FN2O2S
Molecular Weight256.30 g/mol
Exact Mass256.07
IUPAC NameN-(ethylcarbamoyl)-2-(2-fluorophenyl)sulfanylacetamide
SMILESCCNC(=O)NC(=O)CSc1ccccc1F
InChIInChI=1S/C11H13FN2O2S/c1-2-13-11(16)14-10(15)7-17-9-6-4-3-5-8(9)12/h3-6H,2,7H2,1H3,(H2,13,14,15,16)
InChIKeyUTYZFTZBJUVUNL-UHFFFAOYSA-N
XLogP1.76
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(ethylcarbamoyl)-2-(2-fluorophenyl)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-(Phenylthio)ethyl)acetamide
CID 13250272
N-carbamoyl-2-phenylsulfanylacetamide
CID 2470668
N-(propylcarbamoyl)-2-[3-(trifluoromethyl)phenyl]sulfanylacetamide
CID 2592012
2-(2-fluorophenyl)sulfanyl-N-(propan-2-ylcarbamoyl)acetamide
CID 2591492
N-(methylcarbamoyl)-2-[3-(trifluoromethyl)phenyl]sulfanylacetamide
CID 2591984
N-(ethylcarbamoyl)-2-[3-(trifluoromethyl)phenyl]sulfanylacetamide
CID 2591998
N-[2-(2,4-dioxo-1,3-thiazolidin-3-yl)ethyl]-2-(2-fluorophenyl)sulfanylacetamide
CID 4794340
6-Amino-5-(4-fluorophenyl)sulfanyl-1,3-dimethylpyrimidine-2,4-dione
CID 2331013
N-(1-phenylsulfanylpropan-2-yl)acetamide
CID 49865423
N-[(2S)-1-phenylsulfanylpropan-2-yl]acetamide
CID 49865425
5-phenylsulfanyl-1H-pyrimidine-2,4-dione
CID 308734
N-methyl-2-(phenylsulfanyl)acetamide
CID 965608

Frequently Asked Questions

What is the IUPAC name of N-(ethylcarbamoyl)-2-(2-fluorophenyl)sulfanylacetamide?
The IUPAC name of N-(ethylcarbamoyl)-2-(2-fluorophenyl)sulfanylacetamide (CID 2591666) is N-(ethylcarbamoyl)-2-(2-fluorophenyl)sulfanylacetamide.
What is the SMILES notation for N-(ethylcarbamoyl)-2-(2-fluorophenyl)sulfanylacetamide?
The canonical SMILES for N-(ethylcarbamoyl)-2-(2-fluorophenyl)sulfanylacetamide is CCNC(=O)NC(=O)CSc1ccccc1F.
What is the InChIKey of N-(ethylcarbamoyl)-2-(2-fluorophenyl)sulfanylacetamide?
The InChIKey is UTYZFTZBJUVUNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2O2S/c1-2-13-11(16)14-10(15)7-17-9-6-4-3-5-8(9)12/h3-6H,2,7H2,1H3,(H2,13,14,15,16).
What are the key properties of N-(ethylcarbamoyl)-2-(2-fluorophenyl)sulfanylacetamide?
N-(ethylcarbamoyl)-2-(2-fluorophenyl)sulfanylacetamide has a molecular weight of 256.30 g/mol, XLogP of 1.76, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ethylcarbamoyl)-2-(2-fluorophenyl)sulfanylacetamide is sourced from PubChem (CID 2591666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).