2,2-dimethyl-3-(2-oxo-1-pyridinyl)propanehydrazide

C10H15N3O2 — CID 79631172

IUPAC2,2-dimethyl-3-(2-oxo-1-pyridinyl)propanehydrazide
SMILESCC(C)(Cn1ccccc1=O)C(=O)NN
InChIInChI=1S/C10H15N3O2/c1-10(2,9(15)12-11)7-13-6-4-3-5-8(13)14/h3-6H,7,11H2,1-2H3,(H,12,15)
InChIKeyKNCKDBLNSSGYDU-UHFFFAOYSA-N
MW209.25 g/mol
LogP-0.14
Rot. Bonds3

About 2,2-dimethyl-3-(2-oxo-1-pyridinyl)propanehydrazide

2,2-dimethyl-3-(2-oxo-1-pyridinyl)propanehydrazide (PubChem CID 79631172) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 2,2-dimethyl-3-(2-oxo-1-pyridinyl)propanehydrazide.

Molecular Properties

Compound Name2,2-dimethyl-3-(2-oxo-1-pyridinyl)propanehydrazide
PubChem CID79631172
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name2,2-dimethyl-3-(2-oxo-1-pyridinyl)propanehydrazide
SMILESCC(C)(Cn1ccccc1=O)C(=O)NN
InChIInChI=1S/C10H15N3O2/c1-10(2,9(15)12-11)7-13-6-4-3-5-8(13)14/h3-6H,7,11H2,1-2H3,(H,12,15)
InChIKeyKNCKDBLNSSGYDU-UHFFFAOYSA-N
XLogP-0.14
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 5-0.14
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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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-(2-oxo-1-pyridinyl)propanehydrazide?
The IUPAC name of 2,2-dimethyl-3-(2-oxo-1-pyridinyl)propanehydrazide (CID 79631172) is 2,2-dimethyl-3-(2-oxo-1-pyridinyl)propanehydrazide.
What is the SMILES notation for 2,2-dimethyl-3-(2-oxo-1-pyridinyl)propanehydrazide?
The canonical SMILES for 2,2-dimethyl-3-(2-oxo-1-pyridinyl)propanehydrazide is CC(C)(Cn1ccccc1=O)C(=O)NN.
What is the InChIKey of 2,2-dimethyl-3-(2-oxo-1-pyridinyl)propanehydrazide?
The InChIKey is KNCKDBLNSSGYDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-10(2,9(15)12-11)7-13-6-4-3-5-8(13)14/h3-6H,7,11H2,1-2H3,(H,12,15).
What are the key properties of 2,2-dimethyl-3-(2-oxo-1-pyridinyl)propanehydrazide?
2,2-dimethyl-3-(2-oxo-1-pyridinyl)propanehydrazide has a molecular weight of 209.25 g/mol, XLogP of -0.14, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-(2-oxo-1-pyridinyl)propanehydrazide is sourced from PubChem (CID 79631172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).