N'-(4-chloro-2-methylphenyl)thiophene-2-carbohydrazide

C12H11ClN2OS — CID 2811346

IUPACN'-(4-chloro-2-methylphenyl)thiophene-2-carbohydrazide
SMILESCc1cc(Cl)ccc1NNC(=O)c1cccs1
InChIInChI=1S/C12H11ClN2OS/c1-8-7-9(13)4-5-10(8)14-15-12(16)11-3-2-6-17-11/h2-7,14H,1H3,(H,15,16)
InChIKeyOPBJPFYGPTWHOJ-UHFFFAOYSA-N
MW266.75 g/mol
LogP3.47
Rot. Bonds3

About N'-(4-chloro-2-methylphenyl)thiophene-2-carbohydrazide

N'-(4-chloro-2-methylphenyl)thiophene-2-carbohydrazide (PubChem CID 2811346) has the molecular formula C12H11ClN2OS and a molecular weight of 266.75 g/mol. Its IUPAC name is N'-(4-chloro-2-methylphenyl)thiophene-2-carbohydrazide.

Molecular Properties

Compound NameN'-(4-chloro-2-methylphenyl)thiophene-2-carbohydrazide
PubChem CID2811346
Molecular FormulaC12H11ClN2OS
Molecular Weight266.75 g/mol
Exact Mass266.03
IUPAC NameN'-(4-chloro-2-methylphenyl)thiophene-2-carbohydrazide
SMILESCc1cc(Cl)ccc1NNC(=O)c1cccs1
InChIInChI=1S/C12H11ClN2OS/c1-8-7-9(13)4-5-10(8)14-15-12(16)11-3-2-6-17-11/h2-7,14H,1H3,(H,15,16)
InChIKeyOPBJPFYGPTWHOJ-UHFFFAOYSA-N
XLogP3.47
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.75
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N'-(4-chloro-2-methylphenyl)thiophene-2-carbohydrazide 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'-(4-chlorophenyl)thiophene-2-carbohydrazide
CID 2812576
N'-(2,5-dichlorophenyl)-2-thiophenecarbohydrazide
CID 2811009
N'-[2-(trifluoromethyl)phenyl]-2-thiophenecarbohydrazide
CID 2811204
3-chloro-N'-(4-chlorophenyl)-2-thiophenecarbohydrazide
CID 2812568
3-chloro-N'-(2-thiophen-3-ylacetyl)benzohydrazide
CID 7918359
N'-(3-chloro-4-methylphenyl)-2-thiophenecarbohydrazide
CID 2811331
N'-(3,5-dichlorophenyl)-2-thiophenecarbohydrazide
CID 2813078
3-chloro-N'-(4-chloro-2-methylphenyl)thiophene-2-carbohydrazide
CID 2811338
N-[4-chloro-2-(trifluoromethyl)phenyl]-5-methylthiophene-3-carboxamide
CID 1246469
3-chloro-N'-[2-(trifluoromethyl)phenyl]thiophene-2-carbohydrazide
CID 2811196
3-chloro-N'-(2-ethylphenyl)thiophene-2-carbohydrazide
CID 2811984
3-chloro-N'-(2-fluorophenyl)thiophene-2-carbohydrazide
CID 2812141

Frequently Asked Questions

What is the IUPAC name of N'-(4-chloro-2-methylphenyl)thiophene-2-carbohydrazide?
The IUPAC name of N'-(4-chloro-2-methylphenyl)thiophene-2-carbohydrazide (CID 2811346) is N'-(4-chloro-2-methylphenyl)thiophene-2-carbohydrazide.
What is the SMILES notation for N'-(4-chloro-2-methylphenyl)thiophene-2-carbohydrazide?
The canonical SMILES for N'-(4-chloro-2-methylphenyl)thiophene-2-carbohydrazide is Cc1cc(Cl)ccc1NNC(=O)c1cccs1.
What is the InChIKey of N'-(4-chloro-2-methylphenyl)thiophene-2-carbohydrazide?
The InChIKey is OPBJPFYGPTWHOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2OS/c1-8-7-9(13)4-5-10(8)14-15-12(16)11-3-2-6-17-11/h2-7,14H,1H3,(H,15,16).
What are the key properties of N'-(4-chloro-2-methylphenyl)thiophene-2-carbohydrazide?
N'-(4-chloro-2-methylphenyl)thiophene-2-carbohydrazide has a molecular weight of 266.75 g/mol, XLogP of 3.47, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-chloro-2-methylphenyl)thiophene-2-carbohydrazide is sourced from PubChem (CID 2811346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).