N'-(2,6-dichlorophenyl)thiophene-2-carbohydrazide

C11H8Cl2N2OS — CID 2812887

IUPACN'-(2,6-dichlorophenyl)thiophene-2-carbohydrazide
SMILESO=C(NNc1c(Cl)cccc1Cl)c1cccs1
InChIInChI=1S/C11H8Cl2N2OS/c12-7-3-1-4-8(13)10(7)14-15-11(16)9-5-2-6-17-9/h1-6,14H,(H,15,16)
InChIKeyKGGIUPKJYCTCMC-UHFFFAOYSA-N
MW287.17 g/mol
LogP3.81
Rot. Bonds3

About N'-(2,6-dichlorophenyl)thiophene-2-carbohydrazide

N'-(2,6-dichlorophenyl)thiophene-2-carbohydrazide (PubChem CID 2812887) has the molecular formula C11H8Cl2N2OS and a molecular weight of 287.17 g/mol. Its IUPAC name is N'-(2,6-dichlorophenyl)thiophene-2-carbohydrazide.

Molecular Properties

Compound NameN'-(2,6-dichlorophenyl)thiophene-2-carbohydrazide
PubChem CID2812887
Molecular FormulaC11H8Cl2N2OS
Molecular Weight287.17 g/mol
Exact Mass285.97
IUPAC NameN'-(2,6-dichlorophenyl)thiophene-2-carbohydrazide
SMILESO=C(NNc1c(Cl)cccc1Cl)c1cccs1
InChIInChI=1S/C11H8Cl2N2OS/c12-7-3-1-4-8(13)10(7)14-15-11(16)9-5-2-6-17-9/h1-6,14H,(H,15,16)
InChIKeyKGGIUPKJYCTCMC-UHFFFAOYSA-N
XLogP3.81
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.17
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-(2,6-dichlorophenyl)thiophene-2-carbohydrazide?
The IUPAC name of N'-(2,6-dichlorophenyl)thiophene-2-carbohydrazide (CID 2812887) is N'-(2,6-dichlorophenyl)thiophene-2-carbohydrazide.
What is the SMILES notation for N'-(2,6-dichlorophenyl)thiophene-2-carbohydrazide?
The canonical SMILES for N'-(2,6-dichlorophenyl)thiophene-2-carbohydrazide is O=C(NNc1c(Cl)cccc1Cl)c1cccs1.
What is the InChIKey of N'-(2,6-dichlorophenyl)thiophene-2-carbohydrazide?
The InChIKey is KGGIUPKJYCTCMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Cl2N2OS/c12-7-3-1-4-8(13)10(7)14-15-11(16)9-5-2-6-17-9/h1-6,14H,(H,15,16).
What are the key properties of N'-(2,6-dichlorophenyl)thiophene-2-carbohydrazide?
N'-(2,6-dichlorophenyl)thiophene-2-carbohydrazide has a molecular weight of 287.17 g/mol, XLogP of 3.81, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,6-dichlorophenyl)thiophene-2-carbohydrazide is sourced from PubChem (CID 2812887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).