3-(2-methylhydrazinyl)-3-oxo-N-pyridin-3-ylpropanamide

C9H12N4O2 — CID 129281433

IUPAC3-(2-methylhydrazinyl)-3-oxo-N-pyridin-3-ylpropanamide
SMILESCNNC(=O)CC(=O)Nc1cccnc1
InChIInChI=1S/C9H12N4O2/c1-10-13-9(15)5-8(14)12-7-3-2-4-11-6-7/h2-4,6,10H,5H2,1H3,(H,12,14)(H,13,15)
InChIKeyISADXKAIKRQWGG-UHFFFAOYSA-N
MW208.22 g/mol
LogP-0.34
Rot. Bonds4

About 3-(2-methylhydrazinyl)-3-oxo-N-pyridin-3-ylpropanamide

3-(2-methylhydrazinyl)-3-oxo-N-pyridin-3-ylpropanamide (PubChem CID 129281433) has the molecular formula C9H12N4O2 and a molecular weight of 208.22 g/mol. Its IUPAC name is 3-(2-methylhydrazinyl)-3-oxo-N-pyridin-3-ylpropanamide.

Molecular Properties

Compound Name3-(2-methylhydrazinyl)-3-oxo-N-pyridin-3-ylpropanamide
PubChem CID129281433
Molecular FormulaC9H12N4O2
Molecular Weight208.22 g/mol
Exact Mass208.10
IUPAC Name3-(2-methylhydrazinyl)-3-oxo-N-pyridin-3-ylpropanamide
SMILESCNNC(=O)CC(=O)Nc1cccnc1
InChIInChI=1S/C9H12N4O2/c1-10-13-9(15)5-8(14)12-7-3-2-4-11-6-7/h2-4,6,10H,5H2,1H3,(H,12,14)(H,13,15)
InChIKeyISADXKAIKRQWGG-UHFFFAOYSA-N
XLogP-0.34
TPSA83.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 5-0.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[4-[2-oxo-2-(pyridin-3-ylamino)ethyl]phenyl]-N-pyridin-3-ylacetamide
CID 177434462
2-(4-methylphenyl)-N-pyridin-3-ylacetamide
CID 890802
3-acetamido-N-pyridin-3-ylpropanamide
CID 91801519
3-methyl-N-pyridin-3-ylpentanamide
CID 142960765
2-[(2-methylpropan-2-yl)oxy]-N-pyridin-3-ylacetamide
CID 112604829
2-cyclopropyl-N-pyridin-3-ylacetamide
CID 131129634
4-amino-3-methyl-N-pyridin-3-ylbutanamide
CID 81070233
(3R)-3-methyl-5-oxo-5-(pyridin-3-ylamino)pentanoic acid
CID 7316708
3-methyl-N-pyridin-3-ylpentanamide;molecular hydrogen
CID 166133137
N-pyridin-3-ylprop-2-ynamide
CID 130904210
2-(dimethylamino)-4-oxo-4-(pyridin-3-ylamino)butanoic acid
CID 44993995
2-(2-fluorophenyl)-N-pyridin-3-ylacetamide
CID 4195275

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylhydrazinyl)-3-oxo-N-pyridin-3-ylpropanamide?
The IUPAC name of 3-(2-methylhydrazinyl)-3-oxo-N-pyridin-3-ylpropanamide (CID 129281433) is 3-(2-methylhydrazinyl)-3-oxo-N-pyridin-3-ylpropanamide.
What is the SMILES notation for 3-(2-methylhydrazinyl)-3-oxo-N-pyridin-3-ylpropanamide?
The canonical SMILES for 3-(2-methylhydrazinyl)-3-oxo-N-pyridin-3-ylpropanamide is CNNC(=O)CC(=O)Nc1cccnc1.
What is the InChIKey of 3-(2-methylhydrazinyl)-3-oxo-N-pyridin-3-ylpropanamide?
The InChIKey is ISADXKAIKRQWGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O2/c1-10-13-9(15)5-8(14)12-7-3-2-4-11-6-7/h2-4,6,10H,5H2,1H3,(H,12,14)(H,13,15).
What are the key properties of 3-(2-methylhydrazinyl)-3-oxo-N-pyridin-3-ylpropanamide?
3-(2-methylhydrazinyl)-3-oxo-N-pyridin-3-ylpropanamide has a molecular weight of 208.22 g/mol, XLogP of -0.34, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylhydrazinyl)-3-oxo-N-pyridin-3-ylpropanamide is sourced from PubChem (CID 129281433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).