1-[2-(2-methyl-6-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide

C14H20N4O3 — CID 63577083

IUPAC1-[2-(2-methyl-6-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide
SMILESCc1cccc(=O)n1CC(=O)N1CCC(C(=O)NN)CC1
InChIInChI=1S/C14H20N4O3/c1-10-3-2-4-12(19)18(10)9-13(20)17-7-5-11(6-8-17)14(21)16-15/h2-4,11H,5-9,15H2,1H3,(H,16,21)
InChIKeyHHQQONBIQUEKAV-UHFFFAOYSA-N
MW292.34 g/mol
LogP-0.61
Rot. Bonds3

About 1-[2-(2-methyl-6-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide

1-[2-(2-methyl-6-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide (PubChem CID 63577083) has the molecular formula C14H20N4O3 and a molecular weight of 292.34 g/mol. Its IUPAC name is 1-[2-(2-methyl-6-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide.

Molecular Properties

Compound Name1-[2-(2-methyl-6-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide
PubChem CID63577083
Molecular FormulaC14H20N4O3
Molecular Weight292.34 g/mol
Exact Mass292.15
IUPAC Name1-[2-(2-methyl-6-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide
SMILESCc1cccc(=O)n1CC(=O)N1CCC(C(=O)NN)CC1
InChIInChI=1S/C14H20N4O3/c1-10-3-2-4-12(19)18(10)9-13(20)17-7-5-11(6-8-17)14(21)16-15/h2-4,11H,5-9,15H2,1H3,(H,16,21)
InChIKeyHHQQONBIQUEKAV-UHFFFAOYSA-N
XLogP-0.61
TPSA97.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 5-0.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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 1-[2-(2-methyl-6-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide?
The IUPAC name of 1-[2-(2-methyl-6-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide (CID 63577083) is 1-[2-(2-methyl-6-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide.
What is the SMILES notation for 1-[2-(2-methyl-6-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide?
The canonical SMILES for 1-[2-(2-methyl-6-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide is Cc1cccc(=O)n1CC(=O)N1CCC(C(=O)NN)CC1.
What is the InChIKey of 1-[2-(2-methyl-6-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide?
The InChIKey is HHQQONBIQUEKAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O3/c1-10-3-2-4-12(19)18(10)9-13(20)17-7-5-11(6-8-17)14(21)16-15/h2-4,11H,5-9,15H2,1H3,(H,16,21).
What are the key properties of 1-[2-(2-methyl-6-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide?
1-[2-(2-methyl-6-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide has a molecular weight of 292.34 g/mol, XLogP of -0.61, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methyl-6-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide is sourced from PubChem (CID 63577083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).