N-cyclopropyl-4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]benzamide

C18H17FN2O2S — CID 46584778

IUPACN-cyclopropyl-4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]benzamide
SMILESO=C(CSc1ccccc1F)Nc1ccc(C(=O)NC2CC2)cc1
InChIInChI=1S/C18H17FN2O2S/c19-15-3-1-2-4-16(15)24-11-17(22)20-13-7-5-12(6-8-13)18(23)21-14-9-10-14/h1-8,14H,9-11H2,(H,20,22)(H,21,23)
InChIKeySJFLVVOIEFZVPL-UHFFFAOYSA-N
MW344.41 g/mol
LogP3.45
Rot. Bonds6

About N-cyclopropyl-4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]benzamide

N-cyclopropyl-4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]benzamide (PubChem CID 46584778) has the molecular formula C18H17FN2O2S and a molecular weight of 344.41 g/mol. Its IUPAC name is N-cyclopropyl-4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]benzamide
PubChem CID46584778
Molecular FormulaC18H17FN2O2S
Molecular Weight344.41 g/mol
Exact Mass344.10
IUPAC NameN-cyclopropyl-4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]benzamide
SMILESO=C(CSc1ccccc1F)Nc1ccc(C(=O)NC2CC2)cc1
InChIInChI=1S/C18H17FN2O2S/c19-15-3-1-2-4-16(15)24-11-17(22)20-13-7-5-12(6-8-13)18(23)21-14-9-10-14/h1-8,14H,9-11H2,(H,20,22)(H,21,23)
InChIKeySJFLVVOIEFZVPL-UHFFFAOYSA-N
XLogP3.45
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-cyclopropyl-4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]benzamide 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-cyclopropyl-4-[[2-(2,5-dichlorophenyl)sulfanylacetyl]amino]benzamide
CID 55489180
4-[[2-[(4-chlorophenyl)-phenylmethyl]sulfanylacetyl]amino]-N-cyclopropylbenzamide
CID 55489531
N-(4-bromophenyl)-2-(2-fluorophenyl)sulfanylacetamide
CID 2591716
4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]-N-(2-methoxyphenyl)benzamide
CID 4793619
N,N-diethyl-4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]benzamide
CID 7965030
N-cyclopropyl-4-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]amino]benzamide
CID 39977118
N-[4-[2-(2-fluorophenyl)sulfanylacetyl]phenyl]benzamide
CID 7489443
N-cyclopropyl-2-[[2-(2,4-difluorophenyl)sulfanylacetyl]amino]benzamide
CID 9046628
2-(2-fluorophenyl)sulfanyl-N-(4-nitrophenyl)acetamide
CID 7965036
N-[4-(difluoromethoxy)phenyl]-2-(2-fluorophenyl)sulfanylacetamide
CID 2591517
N-[4-[2-(2-fluorophenyl)sulfanylacetyl]phenyl]propanamide
CID 7964698
N-(4-tert-butylphenyl)-2-[2-(cyclopropylamino)-2-oxoethyl]sulfanylbenzamide
CID 25469168

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]benzamide?
The IUPAC name of N-cyclopropyl-4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]benzamide (CID 46584778) is N-cyclopropyl-4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]benzamide.
What is the SMILES notation for N-cyclopropyl-4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]benzamide?
The canonical SMILES for N-cyclopropyl-4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]benzamide is O=C(CSc1ccccc1F)Nc1ccc(C(=O)NC2CC2)cc1.
What is the InChIKey of N-cyclopropyl-4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]benzamide?
The InChIKey is SJFLVVOIEFZVPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN2O2S/c19-15-3-1-2-4-16(15)24-11-17(22)20-13-7-5-12(6-8-13)18(23)21-14-9-10-14/h1-8,14H,9-11H2,(H,20,22)(H,21,23).
What are the key properties of N-cyclopropyl-4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]benzamide?
N-cyclopropyl-4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]benzamide has a molecular weight of 344.41 g/mol, XLogP of 3.45, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]benzamide is sourced from PubChem (CID 46584778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).