2-(2-methylphenyl)sulfanylpropanehydrazide

C10H14N2OS — CID 63582156

IUPAC2-(2-methylphenyl)sulfanylpropanehydrazide
SMILESCc1ccccc1SC(C)C(=O)NN
InChIInChI=1S/C10H14N2OS/c1-7-5-3-4-6-9(7)14-8(2)10(13)12-11/h3-6,8H,11H2,1-2H3,(H,12,13)
InChIKeySLFRYPFCCUJSPL-UHFFFAOYSA-N
MW210.30 g/mol
LogP1.47
Rot. Bonds3

About 2-(2-methylphenyl)sulfanylpropanehydrazide

2-(2-methylphenyl)sulfanylpropanehydrazide (PubChem CID 63582156) has the molecular formula C10H14N2OS and a molecular weight of 210.30 g/mol. Its IUPAC name is 2-(2-methylphenyl)sulfanylpropanehydrazide.

Molecular Properties

Compound Name2-(2-methylphenyl)sulfanylpropanehydrazide
PubChem CID63582156
Molecular FormulaC10H14N2OS
Molecular Weight210.30 g/mol
Exact Mass210.08
IUPAC Name2-(2-methylphenyl)sulfanylpropanehydrazide
SMILESCc1ccccc1SC(C)C(=O)NN
InChIInChI=1S/C10H14N2OS/c1-7-5-3-4-6-9(7)14-8(2)10(13)12-11/h3-6,8H,11H2,1-2H3,(H,12,13)
InChIKeySLFRYPFCCUJSPL-UHFFFAOYSA-N
XLogP1.47
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.30
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(2-chlorophenyl)sulfanylpropanehydrazide
CID 61059907
N-(4-aminophenyl)-2-(2-methylphenyl)sulfanylpropanamide
CID 60892180
2-(2-methylphenyl)sulfanylpropanoic acid
CID 20985535
N-[2-(2,6-dimethylanilino)-2-oxoethyl]-2-(2-methylphenyl)sulfanylpropanamide
CID 60561702
N-(2-ethoxyphenyl)-2-(2-methylphenyl)sulfanylpropanamide
CID 60561490
1-(2-methylphenyl)sulfanylethyl carbamate
CID 70554819
2-(2-methylanilino)propanehydrazide
CID 23833506
2-[1-(2-methylanilino)-1-oxopropan-2-yl]sulfanylbenzoic acid
CID 17494567
2-(2-amino-3-methylphenyl)sulfanyl-N-(methylcarbamoyl)propanamide
CID 79147156
2-(3-bromophenyl)sulfanylpropanehydrazide
CID 63579968
(2R)-2-benzylsulfanylpropanehydrazide
CID 28840047
3-(2-hydroxyphenyl)sulfanyl-2-methylbutanehydrazide
CID 79404719

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylphenyl)sulfanylpropanehydrazide?
The IUPAC name of 2-(2-methylphenyl)sulfanylpropanehydrazide (CID 63582156) is 2-(2-methylphenyl)sulfanylpropanehydrazide.
What is the SMILES notation for 2-(2-methylphenyl)sulfanylpropanehydrazide?
The canonical SMILES for 2-(2-methylphenyl)sulfanylpropanehydrazide is Cc1ccccc1SC(C)C(=O)NN.
What is the InChIKey of 2-(2-methylphenyl)sulfanylpropanehydrazide?
The InChIKey is SLFRYPFCCUJSPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2OS/c1-7-5-3-4-6-9(7)14-8(2)10(13)12-11/h3-6,8H,11H2,1-2H3,(H,12,13).
What are the key properties of 2-(2-methylphenyl)sulfanylpropanehydrazide?
2-(2-methylphenyl)sulfanylpropanehydrazide has a molecular weight of 210.30 g/mol, XLogP of 1.47, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylphenyl)sulfanylpropanehydrazide is sourced from PubChem (CID 63582156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).