3-ethylsulfanyl-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide

C19H22N2O3S — CID 55786556

IUPAC3-ethylsulfanyl-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide
SMILESCCSCCC(=O)NNC(=O)COc1ccccc1-c1ccccc1
InChIInChI=1S/C19H22N2O3S/c1-2-25-13-12-18(22)20-21-19(23)14-24-17-11-7-6-10-16(17)15-8-4-3-5-9-15/h3-11H,2,12-14H2,1H3,(H,20,22)(H,21,23)
InChIKeyUJHMHBSXZPKJPL-UHFFFAOYSA-N
MW358.46 g/mol
LogP3.02
Rot. Bonds8

About 3-ethylsulfanyl-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide

3-ethylsulfanyl-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide (PubChem CID 55786556) has the molecular formula C19H22N2O3S and a molecular weight of 358.46 g/mol. Its IUPAC name is 3-ethylsulfanyl-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide.

Molecular Properties

Compound Name3-ethylsulfanyl-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide
PubChem CID55786556
Molecular FormulaC19H22N2O3S
Molecular Weight358.46 g/mol
Exact Mass358.14
IUPAC Name3-ethylsulfanyl-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide
SMILESCCSCCC(=O)NNC(=O)COc1ccccc1-c1ccccc1
InChIInChI=1S/C19H22N2O3S/c1-2-25-13-12-18(22)20-21-19(23)14-24-17-11-7-6-10-16(17)15-8-4-3-5-9-15/h3-11H,2,12-14H2,1H3,(H,20,22)(H,21,23)
InChIKeyUJHMHBSXZPKJPL-UHFFFAOYSA-N
XLogP3.02
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.46
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 3-ethylsulfanyl-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide 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'-acetyl-2-(2-phenylphenoxy)acetohydrazide
CID 922584
2-(2-methylphenoxy)-N'-[2-(2-phenylphenoxy)acetyl]acetohydrazide
CID 5089372
3-(2-methoxyphenyl)-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide
CID 9470380
3-methyl-N'-[2-(2-phenylphenoxy)acetyl]butanehydrazide
CID 9470420
1-N',4-N'-bis[2-(2-phenylphenoxy)acetyl]benzene-1,4-dicarbohydrazide
CID 3554709
3-(4-methylphenoxy)-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide
CID 7978332
2-methyl-N'-[2-(2-phenylphenoxy)acetyl]pentanehydrazide
CID 78771942
3-cyclopentyl-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide
CID 7978371
2-(2-phenylphenoxy)-N-propylacetamide
CID 112788813
2-(2-phenylphenoxy)-N-prop-2-enylacetamide
CID 7971284
4-(4-fluorophenoxy)-N'-[2-(2-phenylphenoxy)acetyl]butanehydrazide
CID 46632974
2-[[[2-(2-phenylphenoxy)acetyl]amino]carbamoyl]benzoic acid
CID 5088878

Frequently Asked Questions

What is the IUPAC name of 3-ethylsulfanyl-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide?
The IUPAC name of 3-ethylsulfanyl-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide (CID 55786556) is 3-ethylsulfanyl-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide.
What is the SMILES notation for 3-ethylsulfanyl-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide?
The canonical SMILES for 3-ethylsulfanyl-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide is CCSCCC(=O)NNC(=O)COc1ccccc1-c1ccccc1.
What is the InChIKey of 3-ethylsulfanyl-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide?
The InChIKey is UJHMHBSXZPKJPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3S/c1-2-25-13-12-18(22)20-21-19(23)14-24-17-11-7-6-10-16(17)15-8-4-3-5-9-15/h3-11H,2,12-14H2,1H3,(H,20,22)(H,21,23).
What are the key properties of 3-ethylsulfanyl-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide?
3-ethylsulfanyl-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide has a molecular weight of 358.46 g/mol, XLogP of 3.02, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethylsulfanyl-N'-[2-(2-phenylphenoxy)acetyl]propanehydrazide is sourced from PubChem (CID 55786556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).