N'-methylthiophene-3-carbohydrazide

C6H8N2OS — CID 130443742

IUPACN'-methylthiophene-3-carbohydrazide
SMILESCNNC(=O)c1ccsc1
InChIInChI=1S/C6H8N2OS/c1-7-8-6(9)5-2-3-10-4-5/h2-4,7H,1H3,(H,8,9)
InChIKeyQNYWZNWNQSURKA-UHFFFAOYSA-N
MW156.21 g/mol
LogP0.61
Rot. Bonds2

About N'-methylthiophene-3-carbohydrazide

N'-methylthiophene-3-carbohydrazide (PubChem CID 130443742) has the molecular formula C6H8N2OS and a molecular weight of 156.21 g/mol. Its IUPAC name is N'-methylthiophene-3-carbohydrazide.

Molecular Properties

Compound NameN'-methylthiophene-3-carbohydrazide
PubChem CID130443742
Molecular FormulaC6H8N2OS
Molecular Weight156.21 g/mol
Exact Mass156.04
IUPAC NameN'-methylthiophene-3-carbohydrazide
SMILESCNNC(=O)c1ccsc1
InChIInChI=1S/C6H8N2OS/c1-7-8-6(9)5-2-3-10-4-5/h2-4,7H,1H3,(H,8,9)
InChIKeyQNYWZNWNQSURKA-UHFFFAOYSA-N
XLogP0.61
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.21
LogP ≤ 50.61
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'-methylthiophene-3-carbohydrazide?
The IUPAC name of N'-methylthiophene-3-carbohydrazide (CID 130443742) is N'-methylthiophene-3-carbohydrazide.
What is the SMILES notation for N'-methylthiophene-3-carbohydrazide?
The canonical SMILES for N'-methylthiophene-3-carbohydrazide is CNNC(=O)c1ccsc1.
What is the InChIKey of N'-methylthiophene-3-carbohydrazide?
The InChIKey is QNYWZNWNQSURKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2OS/c1-7-8-6(9)5-2-3-10-4-5/h2-4,7H,1H3,(H,8,9).
What are the key properties of N'-methylthiophene-3-carbohydrazide?
N'-methylthiophene-3-carbohydrazide has a molecular weight of 156.21 g/mol, XLogP of 0.61, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methylthiophene-3-carbohydrazide is sourced from PubChem (CID 130443742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).