2-(1-amino-1-oxopropan-2-yl)sulfanyl-N-(3-phenylprop-2-enyl)benzamide

C19H20N2O2S — CID 127265899

IUPAC2-(1-amino-1-oxopropan-2-yl)sulfanyl-N-(3-phenylprop-2-enyl)benzamide
SMILESCC(Sc1ccccc1C(=O)NCC=Cc1ccccc1)C(N)=O
InChIInChI=1S/C19H20N2O2S/c1-14(18(20)22)24-17-12-6-5-11-16(17)19(23)21-13-7-10-15-8-3-2-4-9-15/h2-12,14H,13H2,1H3,(H2,20,22)(H,21,23)
InChIKeyWINSCAAJUFKOQB-UHFFFAOYSA-N
MW340.45 g/mol
LogP3.10
Rot. Bonds7

About 2-(1-amino-1-oxopropan-2-yl)sulfanyl-N-(3-phenylprop-2-enyl)benzamide

2-(1-amino-1-oxopropan-2-yl)sulfanyl-N-(3-phenylprop-2-enyl)benzamide (PubChem CID 127265899) has the molecular formula C19H20N2O2S and a molecular weight of 340.45 g/mol. Its IUPAC name is 2-(1-amino-1-oxopropan-2-yl)sulfanyl-N-(3-phenylprop-2-enyl)benzamide.

Molecular Properties

Compound Name2-(1-amino-1-oxopropan-2-yl)sulfanyl-N-(3-phenylprop-2-enyl)benzamide
PubChem CID127265899
Molecular FormulaC19H20N2O2S
Molecular Weight340.45 g/mol
Exact Mass340.12
IUPAC Name2-(1-amino-1-oxopropan-2-yl)sulfanyl-N-(3-phenylprop-2-enyl)benzamide
SMILESCC(Sc1ccccc1C(=O)NCC=Cc1ccccc1)C(N)=O
InChIInChI=1S/C19H20N2O2S/c1-14(18(20)22)24-17-12-6-5-11-16(17)19(23)21-13-7-10-15-8-3-2-4-9-15/h2-12,14H,13H2,1H3,(H2,20,22)(H,21,23)
InChIKeyWINSCAAJUFKOQB-UHFFFAOYSA-N
XLogP3.10
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(1-amino-1-oxopropan-2-yl)sulfanyl-N-(3-phenylprop-2-enyl)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

2-[(2S)-1-amino-1-oxopropan-2-yl]sulfanyl-N-[2-(1-methylcyclopropyl)ethyl]benzamide
CID 124854776
methyl 2-(3-phenylprop-2-enylamino)propanoate
CID 78989064
2-[(2S)-1-amino-1-oxopropan-2-yl]sulfanyl-N-[[(2R)-1-ethylpiperidin-2-yl]methyl]benzamide
CID 124730047
3-phenylprop-2-enylcarbamothioic S-acid
CID 173357040
methyl 2-[2-(prop-2-ynylcarbamoyl)phenyl]sulfanylpropanoate
CID 60528568
N-(3-phenylprop-2-enyl)hexanamide
CID 54485378
2-[(2S)-1-amino-1-oxopropan-2-yl]sulfanyl-N-(4-ethyl-3-fluorophenyl)benzamide
CID 100743961
8-hydroxy-N-(3-phenylprop-2-enyl)quinoline-7-carboxamide
CID 68896999
8-hydroxy-N-[(E)-3-phenylprop-2-enyl]quinoline-7-carboxamide
CID 22346434
methyl 2-[2-[(4-carbamoylphenyl)methylcarbamoyl]phenyl]sulfanylpropanoate
CID 51121031
methyl 2-[2-(3-phenoxypropylcarbamoyl)phenyl]sulfanylpropanoate
CID 55870912
N-(3-aminobutyl)-2-propan-2-ylsulfanylbenzamide
CID 119498074

Frequently Asked Questions

What is the IUPAC name of 2-(1-amino-1-oxopropan-2-yl)sulfanyl-N-(3-phenylprop-2-enyl)benzamide?
The IUPAC name of 2-(1-amino-1-oxopropan-2-yl)sulfanyl-N-(3-phenylprop-2-enyl)benzamide (CID 127265899) is 2-(1-amino-1-oxopropan-2-yl)sulfanyl-N-(3-phenylprop-2-enyl)benzamide.
What is the SMILES notation for 2-(1-amino-1-oxopropan-2-yl)sulfanyl-N-(3-phenylprop-2-enyl)benzamide?
The canonical SMILES for 2-(1-amino-1-oxopropan-2-yl)sulfanyl-N-(3-phenylprop-2-enyl)benzamide is CC(Sc1ccccc1C(=O)NCC=Cc1ccccc1)C(N)=O.
What is the InChIKey of 2-(1-amino-1-oxopropan-2-yl)sulfanyl-N-(3-phenylprop-2-enyl)benzamide?
The InChIKey is WINSCAAJUFKOQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2S/c1-14(18(20)22)24-17-12-6-5-11-16(17)19(23)21-13-7-10-15-8-3-2-4-9-15/h2-12,14H,13H2,1H3,(H2,20,22)(H,21,23).
What are the key properties of 2-(1-amino-1-oxopropan-2-yl)sulfanyl-N-(3-phenylprop-2-enyl)benzamide?
2-(1-amino-1-oxopropan-2-yl)sulfanyl-N-(3-phenylprop-2-enyl)benzamide has a molecular weight of 340.45 g/mol, XLogP of 3.10, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-amino-1-oxopropan-2-yl)sulfanyl-N-(3-phenylprop-2-enyl)benzamide is sourced from PubChem (CID 127265899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).