4-(4-hydrazinyl-2-methyl-6-oxo-1-pyridinyl)butanoic acid

C10H15N3O3 — CID 4173479

IUPAC4-(4-hydrazinyl-2-methyl-6-oxo-1-pyridinyl)butanoic acid
SMILESCc1cc(NN)cc(=O)n1CCCC(=O)O
InChIInChI=1S/C10H15N3O3/c1-7-5-8(12-11)6-9(14)13(7)4-2-3-10(15)16/h5-6,12H,2-4,11H2,1H3,(H,15,16)
InChIKeyKCFFOBVCKQRENL-UHFFFAOYSA-N
MW225.25 g/mol
LogP0.31
Rot. Bonds5

About 4-(4-hydrazinyl-2-methyl-6-oxo-1-pyridinyl)butanoic acid

4-(4-hydrazinyl-2-methyl-6-oxo-1-pyridinyl)butanoic acid (PubChem CID 4173479) has the molecular formula C10H15N3O3 and a molecular weight of 225.25 g/mol. Its IUPAC name is 4-(4-hydrazinyl-2-methyl-6-oxo-1-pyridinyl)butanoic acid.

Molecular Properties

Compound Name4-(4-hydrazinyl-2-methyl-6-oxo-1-pyridinyl)butanoic acid
PubChem CID4173479
Molecular FormulaC10H15N3O3
Molecular Weight225.25 g/mol
Exact Mass225.11
IUPAC Name4-(4-hydrazinyl-2-methyl-6-oxo-1-pyridinyl)butanoic acid
SMILESCc1cc(NN)cc(=O)n1CCCC(=O)O
InChIInChI=1S/C10H15N3O3/c1-7-5-8(12-11)6-9(14)13(7)4-2-3-10(15)16/h5-6,12H,2-4,11H2,1H3,(H,15,16)
InChIKeyKCFFOBVCKQRENL-UHFFFAOYSA-N
XLogP0.31
TPSA97.35 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 50.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-(4-hydrazinyl-2-methyl-6-oxo-1-pyridinyl)butanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(4-hydrazinyl-2-methyl-6-oxo-1-pyridinyl)butanoic acid?
The IUPAC name of 4-(4-hydrazinyl-2-methyl-6-oxo-1-pyridinyl)butanoic acid (CID 4173479) is 4-(4-hydrazinyl-2-methyl-6-oxo-1-pyridinyl)butanoic acid.
What is the SMILES notation for 4-(4-hydrazinyl-2-methyl-6-oxo-1-pyridinyl)butanoic acid?
The canonical SMILES for 4-(4-hydrazinyl-2-methyl-6-oxo-1-pyridinyl)butanoic acid is Cc1cc(NN)cc(=O)n1CCCC(=O)O.
What is the InChIKey of 4-(4-hydrazinyl-2-methyl-6-oxo-1-pyridinyl)butanoic acid?
The InChIKey is KCFFOBVCKQRENL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3/c1-7-5-8(12-11)6-9(14)13(7)4-2-3-10(15)16/h5-6,12H,2-4,11H2,1H3,(H,15,16).
What are the key properties of 4-(4-hydrazinyl-2-methyl-6-oxo-1-pyridinyl)butanoic acid?
4-(4-hydrazinyl-2-methyl-6-oxo-1-pyridinyl)butanoic acid has a molecular weight of 225.25 g/mol, XLogP of 0.31, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-hydrazinyl-2-methyl-6-oxo-1-pyridinyl)butanoic acid is sourced from PubChem (CID 4173479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).