2-(difluoromethyl)-N',N'-dimethylthiophene-3-carbohydrazide

C8H10F2N2OS — CID 126483661

IUPAC2-(difluoromethyl)-N',N'-dimethylthiophene-3-carbohydrazide
SMILESCN(C)NC(=O)c1ccsc1C(F)F
InChIInChI=1S/C8H10F2N2OS/c1-12(2)11-8(13)5-3-4-14-6(5)7(9)10/h3-4,7H,1-2H3,(H,11,13)
InChIKeySRKTWPGUTRBHBG-UHFFFAOYSA-N
MW220.24 g/mol
LogP1.89
Rot. Bonds3

About 2-(difluoromethyl)-N',N'-dimethylthiophene-3-carbohydrazide

2-(difluoromethyl)-N',N'-dimethylthiophene-3-carbohydrazide (PubChem CID 126483661) has the molecular formula C8H10F2N2OS and a molecular weight of 220.24 g/mol. Its IUPAC name is 2-(difluoromethyl)-N',N'-dimethylthiophene-3-carbohydrazide.

Molecular Properties

Compound Name2-(difluoromethyl)-N',N'-dimethylthiophene-3-carbohydrazide
PubChem CID126483661
Molecular FormulaC8H10F2N2OS
Molecular Weight220.24 g/mol
Exact Mass220.05
IUPAC Name2-(difluoromethyl)-N',N'-dimethylthiophene-3-carbohydrazide
SMILESCN(C)NC(=O)c1ccsc1C(F)F
InChIInChI=1S/C8H10F2N2OS/c1-12(2)11-8(13)5-3-4-14-6(5)7(9)10/h3-4,7H,1-2H3,(H,11,13)
InChIKeySRKTWPGUTRBHBG-UHFFFAOYSA-N
XLogP1.89
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.24
LogP ≤ 51.89
H-Bond Donors ≤ 51
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 2-(difluoromethyl)-N',N'-dimethylthiophene-3-carbohydrazide?
The IUPAC name of 2-(difluoromethyl)-N',N'-dimethylthiophene-3-carbohydrazide (CID 126483661) is 2-(difluoromethyl)-N',N'-dimethylthiophene-3-carbohydrazide.
What is the SMILES notation for 2-(difluoromethyl)-N',N'-dimethylthiophene-3-carbohydrazide?
The canonical SMILES for 2-(difluoromethyl)-N',N'-dimethylthiophene-3-carbohydrazide is CN(C)NC(=O)c1ccsc1C(F)F.
What is the InChIKey of 2-(difluoromethyl)-N',N'-dimethylthiophene-3-carbohydrazide?
The InChIKey is SRKTWPGUTRBHBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2OS/c1-12(2)11-8(13)5-3-4-14-6(5)7(9)10/h3-4,7H,1-2H3,(H,11,13).
What are the key properties of 2-(difluoromethyl)-N',N'-dimethylthiophene-3-carbohydrazide?
2-(difluoromethyl)-N',N'-dimethylthiophene-3-carbohydrazide has a molecular weight of 220.24 g/mol, XLogP of 1.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-N',N'-dimethylthiophene-3-carbohydrazide is sourced from PubChem (CID 126483661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).