2-methyl-1,3-thiazole-4-carbohydrazide

C5H7N3OS — CID 2744058

IUPAC2-methyl-1,3-thiazole-4-carbohydrazide
SMILESCc1nc(C(=O)NN)cs1
InChIInChI=1S/C5H7N3OS/c1-3-7-4(2-10-3)5(9)8-6/h2H,6H2,1H3,(H,8,9)
InChIKeyONAWFUIPKRAZKL-UHFFFAOYSA-N
MW157.20 g/mol
LogP0.06
Rot. Bonds1

About 2-methyl-1,3-thiazole-4-carbohydrazide

2-methyl-1,3-thiazole-4-carbohydrazide (PubChem CID 2744058) has the molecular formula C5H7N3OS and a molecular weight of 157.20 g/mol. Its IUPAC name is 2-methyl-1,3-thiazole-4-carbohydrazide.

Molecular Properties

Compound Name2-methyl-1,3-thiazole-4-carbohydrazide
PubChem CID2744058
Molecular FormulaC5H7N3OS
Molecular Weight157.20 g/mol
Exact Mass157.03
IUPAC Name2-methyl-1,3-thiazole-4-carbohydrazide
SMILESCc1nc(C(=O)NN)cs1
InChIInChI=1S/C5H7N3OS/c1-3-7-4(2-10-3)5(9)8-6/h2H,6H2,1H3,(H,8,9)
InChIKeyONAWFUIPKRAZKL-UHFFFAOYSA-N
XLogP0.06
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.20
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-Amino-1,3-thiazole-4-carbohydrazide
CID 468685
Thiazole-4-carbohydrazide
CID 468666
2-Methyl-1,3-thiazole-4-carboxylic acid amide
CID 7019409
2-(Aminomethyl)-1,3-thiazole-4-carboxamide
CID 18003418
2-Bromo-1,3-thiazole-4-carboxamide
CID 45789632
2-(1-Aminoethyl)thiazole-4-carbohydrazide
CID 485038
2-(Azidomethyl)-1,3-thiazole-4-carboxamide
CID 122164053
1-Methyl-3-[(2-methyl-1,3-thiazole-4-carbonyl)amino]thiourea
CID 2744061
2-Formyl-1,3-thiazole-4-carboxamide
CID 11622373
Thiazole-diamide
CID 21616754
2-Fluoro-1,3-thiazole-4-carboxamide
CID 58001584
2-(Trifluoromethyl)thiazole-4-carboxamide
CID 68572341

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1,3-thiazole-4-carbohydrazide?
The IUPAC name of 2-methyl-1,3-thiazole-4-carbohydrazide (CID 2744058) is 2-methyl-1,3-thiazole-4-carbohydrazide.
What is the SMILES notation for 2-methyl-1,3-thiazole-4-carbohydrazide?
The canonical SMILES for 2-methyl-1,3-thiazole-4-carbohydrazide is Cc1nc(C(=O)NN)cs1.
What is the InChIKey of 2-methyl-1,3-thiazole-4-carbohydrazide?
The InChIKey is ONAWFUIPKRAZKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3OS/c1-3-7-4(2-10-3)5(9)8-6/h2H,6H2,1H3,(H,8,9).
What are the key properties of 2-methyl-1,3-thiazole-4-carbohydrazide?
2-methyl-1,3-thiazole-4-carbohydrazide has a molecular weight of 157.20 g/mol, XLogP of 0.06, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1,3-thiazole-4-carbohydrazide is sourced from PubChem (CID 2744058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).