2-fluoro-N-[2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl]benzamide

C17H19FN2O2S — CID 17421518

IUPAC2-fluoro-N-[2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl]benzamide
SMILESCC(C)C(NC(=O)CNC(=O)c1ccccc1F)c1cccs1
InChIInChI=1S/C17H19FN2O2S/c1-11(2)16(14-8-5-9-23-14)20-15(21)10-19-17(22)12-6-3-4-7-13(12)18/h3-9,11,16H,10H2,1-2H3,(H,19,22)(H,20,21)
InChIKeyDOICXHVAQVSJLO-UHFFFAOYSA-N
MW334.42 g/mol
LogP3.13
Rot. Bonds6

About 2-fluoro-N-[2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl]benzamide

2-fluoro-N-[2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl]benzamide (PubChem CID 17421518) has the molecular formula C17H19FN2O2S and a molecular weight of 334.42 g/mol. Its IUPAC name is 2-fluoro-N-[2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl]benzamide
PubChem CID17421518
Molecular FormulaC17H19FN2O2S
Molecular Weight334.42 g/mol
Exact Mass334.12
IUPAC Name2-fluoro-N-[2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl]benzamide
SMILESCC(C)C(NC(=O)CNC(=O)c1ccccc1F)c1cccs1
InChIInChI=1S/C17H19FN2O2S/c1-11(2)16(14-8-5-9-23-14)20-15(21)10-19-17(22)12-6-3-4-7-13(12)18/h3-9,11,16H,10H2,1-2H3,(H,19,22)(H,20,21)
InChIKeyDOICXHVAQVSJLO-UHFFFAOYSA-N
XLogP3.13
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-fluoro-N-[2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl]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-[2-(dimethylamino)-2-thiophen-2-ylethyl]-2-fluorobenzamide
CID 18161749
2-fluoro-N-[2-(2-methylpropylamino)-2-oxoethyl]benzamide
CID 40623473
2-bromo-5-fluoro-N-[3-[(2-methyl-1-thiophen-2-ylpropyl)amino]-3-oxopropyl]benzamide
CID 55792738
N-[2-(1,1-diphenylpropan-2-ylamino)-2-oxoethyl]-2-fluorobenzamide
CID 42959561
4-ethoxy-N-[2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl]benzamide
CID 46678584
2-bromo-N-(2-methyl-1-thiophen-2-ylpropyl)acetamide
CID 63681207
2-fluoro-N-[2-[[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]-2-oxoethyl]benzamide
CID 39951277
2-fluoro-N-[2-[(1-hydroxy-4-methylpentan-2-yl)amino]-2-oxoethyl]benzamide
CID 61247074
2-[[2-[(2-fluorobenzoyl)amino]acetyl]amino]butanoic acid
CID 43387751
2-fluoro-N-[2-[[(2S)-1-hydroxybutan-2-yl]amino]-2-oxoethyl]benzamide
CID 104981439
[(2R)-1-amino-1-oxopropan-2-yl] 2-[(2-fluorobenzoyl)amino]acetate
CID 9270269
2-fluoro-N-[2-(methoxyamino)-2-oxoethyl]benzamide
CID 60717185

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl]benzamide?
The IUPAC name of 2-fluoro-N-[2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl]benzamide (CID 17421518) is 2-fluoro-N-[2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl]benzamide.
What is the SMILES notation for 2-fluoro-N-[2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl]benzamide?
The canonical SMILES for 2-fluoro-N-[2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl]benzamide is CC(C)C(NC(=O)CNC(=O)c1ccccc1F)c1cccs1.
What is the InChIKey of 2-fluoro-N-[2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl]benzamide?
The InChIKey is DOICXHVAQVSJLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O2S/c1-11(2)16(14-8-5-9-23-14)20-15(21)10-19-17(22)12-6-3-4-7-13(12)18/h3-9,11,16H,10H2,1-2H3,(H,19,22)(H,20,21).
What are the key properties of 2-fluoro-N-[2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl]benzamide?
2-fluoro-N-[2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl]benzamide has a molecular weight of 334.42 g/mol, XLogP of 3.13, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 17421518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).