N-(4-fluorophenyl)-2-(1-propylindol-3-yl)sulfanylacetamide

C19H19FN2OS — CID 4644154

IUPACN-(4-fluorophenyl)-2-(1-propylindol-3-yl)sulfanylacetamide
SMILESCCCn1cc(SCC(=O)Nc2ccc(F)cc2)c2ccccc21
InChIInChI=1S/C19H19FN2OS/c1-2-11-22-12-18(16-5-3-4-6-17(16)22)24-13-19(23)21-15-9-7-14(20)8-10-15/h3-10,12H,2,11,13H2,1H3,(H,21,23)
InChIKeyKGYSRFLILIUSTJ-UHFFFAOYSA-N
MW342.44 g/mol
LogP4.92
Rot. Bonds6

About N-(4-fluorophenyl)-2-(1-propylindol-3-yl)sulfanylacetamide

N-(4-fluorophenyl)-2-(1-propylindol-3-yl)sulfanylacetamide (PubChem CID 4644154) has the molecular formula C19H19FN2OS and a molecular weight of 342.44 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-(1-propylindol-3-yl)sulfanylacetamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-(1-propylindol-3-yl)sulfanylacetamide
PubChem CID4644154
Molecular FormulaC19H19FN2OS
Molecular Weight342.44 g/mol
Exact Mass342.12
IUPAC NameN-(4-fluorophenyl)-2-(1-propylindol-3-yl)sulfanylacetamide
SMILESCCCn1cc(SCC(=O)Nc2ccc(F)cc2)c2ccccc21
InChIInChI=1S/C19H19FN2OS/c1-2-11-22-12-18(16-5-3-4-6-17(16)22)24-13-19(23)21-15-9-7-14(20)8-10-15/h3-10,12H,2,11,13H2,1H3,(H,21,23)
InChIKeyKGYSRFLILIUSTJ-UHFFFAOYSA-N
XLogP4.92
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(4-fluorophenyl)-2-(1-propylindol-3-yl)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

GR-159897
CID 9953599
2-[[1-(Phenylmethyl)-1H-indol-3-yl]thio]acetic acid
CID 563550
2-(3-(phenylsulfonyl)-1H-indol-1-yl)ethanamine
CID 10017687
3-(phenylsulfonyl)-1-(piperidin-3-yl)-1H-indole
CID 10042892
3-(phenylsulfonyl)-1-(piperidin-4-yl)-1H-indole
CID 10246639
N-(pyridin-2-ylmethyl)-2-(2-thien-2-yl-1H-indol-1-yl)acetamide
CID 46275360
2-(1-methyl-3-methylsulfanylindol-2-yl)-N-phenylacetamide
CID 555263
2-((1H-indol-3-yl)thio)aniline
CID 693281
Flipped tryptamine derivative, 10
CID 24768515
2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone
CID 2153508
N-(4-fluorobenzyl)-4-(1-methyl-1H-indol-3-yl)butanamide
CID 16018142
N-(3-fluorobenzyl)-4-(1-methyl-1H-indol-3-yl)butanamide
CID 22522928

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-(1-propylindol-3-yl)sulfanylacetamide?
The IUPAC name of N-(4-fluorophenyl)-2-(1-propylindol-3-yl)sulfanylacetamide (CID 4644154) is N-(4-fluorophenyl)-2-(1-propylindol-3-yl)sulfanylacetamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-(1-propylindol-3-yl)sulfanylacetamide?
The canonical SMILES for N-(4-fluorophenyl)-2-(1-propylindol-3-yl)sulfanylacetamide is CCCn1cc(SCC(=O)Nc2ccc(F)cc2)c2ccccc21.
What is the InChIKey of N-(4-fluorophenyl)-2-(1-propylindol-3-yl)sulfanylacetamide?
The InChIKey is KGYSRFLILIUSTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN2OS/c1-2-11-22-12-18(16-5-3-4-6-17(16)22)24-13-19(23)21-15-9-7-14(20)8-10-15/h3-10,12H,2,11,13H2,1H3,(H,21,23).
What are the key properties of N-(4-fluorophenyl)-2-(1-propylindol-3-yl)sulfanylacetamide?
N-(4-fluorophenyl)-2-(1-propylindol-3-yl)sulfanylacetamide has a molecular weight of 342.44 g/mol, XLogP of 4.92, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-(1-propylindol-3-yl)sulfanylacetamide is sourced from PubChem (CID 4644154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).