2-(3-methyl-1,2-oxazol-5-yl)acetohydrazide;hydrochloride

C6H10ClN3O2 — CID 66651040

IUPAC2-(3-methyl-1,2-oxazol-5-yl)acetohydrazide;hydrochloride
SMILESCc1cc(CC(=O)NN)on1.Cl
InChIInChI=1S/C6H9N3O2.ClH/c1-4-2-5(11-9-4)3-6(10)8-7;/h2H,3,7H2,1H3,(H,8,10);1H
InChIKeyQIMWBSATGZOIDL-UHFFFAOYSA-N
MW191.62 g/mol
LogP-0.06
Rot. Bonds2

About 2-(3-methyl-1,2-oxazol-5-yl)acetohydrazide;hydrochloride

2-(3-methyl-1,2-oxazol-5-yl)acetohydrazide;hydrochloride (PubChem CID 66651040) has the molecular formula C6H10ClN3O2 and a molecular weight of 191.62 g/mol. Its IUPAC name is 2-(3-methyl-1,2-oxazol-5-yl)acetohydrazide;hydrochloride.

Molecular Properties

Compound Name2-(3-methyl-1,2-oxazol-5-yl)acetohydrazide;hydrochloride
PubChem CID66651040
Molecular FormulaC6H10ClN3O2
Molecular Weight191.62 g/mol
Exact Mass191.05
IUPAC Name2-(3-methyl-1,2-oxazol-5-yl)acetohydrazide;hydrochloride
SMILESCc1cc(CC(=O)NN)on1.Cl
InChIInChI=1S/C6H9N3O2.ClH/c1-4-2-5(11-9-4)3-6(10)8-7;/h2H,3,7H2,1H3,(H,8,10);1H
InChIKeyQIMWBSATGZOIDL-UHFFFAOYSA-N
XLogP-0.06
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.62
LogP ≤ 5-0.06
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

(2S)-N-methyl-2-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]butanediamide
CID 58709460
2-(3-methyl-1,2-oxazol-5-yl)-N-(5-sulfanylidene-1,2-dihydropyrazol-3-yl)acetamide
CID 164879655
N-(2-ethylphenyl)-2-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 67575573
N-(4,6-dimethyl-1H-pyrazolo[5,4-b]pyridin-3-yl)-2-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 157017723
2-amino-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-phenylpropanamide;hydrochloride
CID 120590598
2-(3-methyl-1,2-oxazol-5-yl)-1-pyrrolidin-1-ylethanone
CID 142572752
ethyl N-[(3-methyl-1,2-oxazol-5-yl)methyl]carbamate
CID 62189875
N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 90650767
N-cyclopropyl-2-[4-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]phenyl]acetamide
CID 131897959
N-[(2R)-2-(dimethylamino)-2-(4-methylphenyl)ethyl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 125154955
1-(4-chlorophenyl)-2-(3-methyl-1,2-oxazol-5-yl)ethanone
CID 15239218
1-methyl-3-[(3-methyl-1,2-oxazol-5-yl)methyl]urea
CID 53017221

Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-1,2-oxazol-5-yl)acetohydrazide;hydrochloride?
The IUPAC name of 2-(3-methyl-1,2-oxazol-5-yl)acetohydrazide;hydrochloride (CID 66651040) is 2-(3-methyl-1,2-oxazol-5-yl)acetohydrazide;hydrochloride.
What is the SMILES notation for 2-(3-methyl-1,2-oxazol-5-yl)acetohydrazide;hydrochloride?
The canonical SMILES for 2-(3-methyl-1,2-oxazol-5-yl)acetohydrazide;hydrochloride is Cc1cc(CC(=O)NN)on1.Cl.
What is the InChIKey of 2-(3-methyl-1,2-oxazol-5-yl)acetohydrazide;hydrochloride?
The InChIKey is QIMWBSATGZOIDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2.ClH/c1-4-2-5(11-9-4)3-6(10)8-7;/h2H,3,7H2,1H3,(H,8,10);1H.
What are the key properties of 2-(3-methyl-1,2-oxazol-5-yl)acetohydrazide;hydrochloride?
2-(3-methyl-1,2-oxazol-5-yl)acetohydrazide;hydrochloride has a molecular weight of 191.62 g/mol, XLogP of -0.06, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-1,2-oxazol-5-yl)acetohydrazide;hydrochloride is sourced from PubChem (CID 66651040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).