2-(1,3-thiazol-4-yl)acetohydrazide

C5H7N3OS — CID 53297918

IUPAC2-(1,3-thiazol-4-yl)acetohydrazide
SMILESNNC(=O)Cc1cscn1
InChIInChI=1S/C5H7N3OS/c6-8-5(9)1-4-2-10-3-7-4/h2-3H,1,6H2,(H,8,9)
InChIKeyFODOKIAJODLDSB-UHFFFAOYSA-N
MW157.20 g/mol
LogP-0.32
Rot. Bonds2

About 2-(1,3-thiazol-4-yl)acetohydrazide

2-(1,3-thiazol-4-yl)acetohydrazide (PubChem CID 53297918) has the molecular formula C5H7N3OS and a molecular weight of 157.20 g/mol. Its IUPAC name is 2-(1,3-thiazol-4-yl)acetohydrazide.

Molecular Properties

Compound Name2-(1,3-thiazol-4-yl)acetohydrazide
PubChem CID53297918
Molecular FormulaC5H7N3OS
Molecular Weight157.20 g/mol
Exact Mass157.03
IUPAC Name2-(1,3-thiazol-4-yl)acetohydrazide
SMILESNNC(=O)Cc1cscn1
InChIInChI=1S/C5H7N3OS/c6-8-5(9)1-4-2-10-3-7-4/h2-3H,1,6H2,(H,8,9)
InChIKeyFODOKIAJODLDSB-UHFFFAOYSA-N
XLogP-0.32
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.20
LogP ≤ 5-0.32
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

N-ethyl-2-(1,3-thiazol-4-yl)acetamide
CID 110462780
CID 163960954
CID 163960954
N-(4-tert-butylphenyl)-2-(1,3-thiazol-4-yl)acetamide
CID 110462979
N-[2-(4-aminophenyl)ethyl]-2-(1,3-thiazol-4-yl)acetamide
CID 110483325
2-(1,3-thiazol-4-yl)-N-(2,4,6-trimethylphenyl)acetamide
CID 54326383
N-(2-tert-butylphenyl)-2-(1,3-thiazol-4-yl)acetamide
CID 110462978
2-(1,3-thiazol-4-yl)-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
CID 155969654
1,3-thiazole-4-carbohydrazide;hydrochloride
CID 146013643
N-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-(1,3-thiazol-4-yl)acetamide
CID 138035437
2-pyrimidin-4-ylacetohydrazide
CID 156821377
N-(2,5-dimethylpyrazol-3-yl)-2-(1,3-thiazol-4-yl)acetamide
CID 110472608
1,3-thiazol-4-ylmethylhydrazine;dihydrochloride
CID 133057420

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-thiazol-4-yl)acetohydrazide?
The IUPAC name of 2-(1,3-thiazol-4-yl)acetohydrazide (CID 53297918) is 2-(1,3-thiazol-4-yl)acetohydrazide.
What is the SMILES notation for 2-(1,3-thiazol-4-yl)acetohydrazide?
The canonical SMILES for 2-(1,3-thiazol-4-yl)acetohydrazide is NNC(=O)Cc1cscn1.
What is the InChIKey of 2-(1,3-thiazol-4-yl)acetohydrazide?
The InChIKey is FODOKIAJODLDSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3OS/c6-8-5(9)1-4-2-10-3-7-4/h2-3H,1,6H2,(H,8,9).
What are the key properties of 2-(1,3-thiazol-4-yl)acetohydrazide?
2-(1,3-thiazol-4-yl)acetohydrazide has a molecular weight of 157.20 g/mol, XLogP of -0.32, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-thiazol-4-yl)acetohydrazide is sourced from PubChem (CID 53297918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).