2-methyl-2-pyridin-4-ylpropanehydrazide;hydrochloride

C9H14ClN3O — CID 131964184

IUPAC2-methyl-2-pyridin-4-ylpropanehydrazide;hydrochloride
SMILESCC(C)(C(=O)NN)c1ccncc1.Cl
InChIInChI=1S/C9H13N3O.ClH/c1-9(2,8(13)12-10)7-3-5-11-6-4-7;/h3-6H,10H2,1-2H3,(H,12,13);1H
InChIKeyWCDAJHZBGUNJPX-UHFFFAOYSA-N
MW215.68 g/mol
LogP0.77
Rot. Bonds2

About 2-methyl-2-pyridin-4-ylpropanehydrazide;hydrochloride

2-methyl-2-pyridin-4-ylpropanehydrazide;hydrochloride (PubChem CID 131964184) has the molecular formula C9H14ClN3O and a molecular weight of 215.68 g/mol. Its IUPAC name is 2-methyl-2-pyridin-4-ylpropanehydrazide;hydrochloride.

Molecular Properties

Compound Name2-methyl-2-pyridin-4-ylpropanehydrazide;hydrochloride
PubChem CID131964184
Molecular FormulaC9H14ClN3O
Molecular Weight215.68 g/mol
Exact Mass215.08
IUPAC Name2-methyl-2-pyridin-4-ylpropanehydrazide;hydrochloride
SMILESCC(C)(C(=O)NN)c1ccncc1.Cl
InChIInChI=1S/C9H13N3O.ClH/c1-9(2,8(13)12-10)7-3-5-11-6-4-7;/h3-6H,10H2,1-2H3,(H,12,13);1H
InChIKeyWCDAJHZBGUNJPX-UHFFFAOYSA-N
XLogP0.77
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.68
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

methyl 2-methyl-2-pyridin-4-ylpropanoate
CID 57421204
2-amino-2-pyridin-4-ylpropanoic acid;hydrochloride
CID 146014247
2-methyl-2-quinolin-6-ylpropanehydrazide
CID 66927115
1,3-bis(2-pyridin-4-ylpropan-2-yl)urea
CID 4120557
2-(4-fluoro-3-methylphenyl)-2-methylpropanehydrazide
CID 116843969
hydrazinecarboxylic acid;pyridine-4-carboxylic acid
CID 161178249
pyridine-4-carbohydrazide;trihydrate;hydrochloride
CID 67630424
methyl (3S)-3-amino-3-pyridin-4-ylbutanoate
CID 97049448
2,2-difluoro-3-hydroxy-3-pyridin-4-ylpropanehydrazide
CID 14976002
4-tert-butylpyridine;formic acid
CID 174881162
tetrakis(4-tert-butylpyridine);bis(molybdenum(2+));tetrachloride
CID 139134561
4-(2-pyridin-4-ylpropan-2-yl)pyridine
CID 20584229

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-pyridin-4-ylpropanehydrazide;hydrochloride?
The IUPAC name of 2-methyl-2-pyridin-4-ylpropanehydrazide;hydrochloride (CID 131964184) is 2-methyl-2-pyridin-4-ylpropanehydrazide;hydrochloride.
What is the SMILES notation for 2-methyl-2-pyridin-4-ylpropanehydrazide;hydrochloride?
The canonical SMILES for 2-methyl-2-pyridin-4-ylpropanehydrazide;hydrochloride is CC(C)(C(=O)NN)c1ccncc1.Cl.
What is the InChIKey of 2-methyl-2-pyridin-4-ylpropanehydrazide;hydrochloride?
The InChIKey is WCDAJHZBGUNJPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O.ClH/c1-9(2,8(13)12-10)7-3-5-11-6-4-7;/h3-6H,10H2,1-2H3,(H,12,13);1H.
What are the key properties of 2-methyl-2-pyridin-4-ylpropanehydrazide;hydrochloride?
2-methyl-2-pyridin-4-ylpropanehydrazide;hydrochloride has a molecular weight of 215.68 g/mol, XLogP of 0.77, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-pyridin-4-ylpropanehydrazide;hydrochloride is sourced from PubChem (CID 131964184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).