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

C14H20N4O3 — CID 63580019

IUPAC1-[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide
SMILESCc1ccn(CC(=O)N2CCC(C(=O)NN)CC2)c(=O)c1
InChIInChI=1S/C14H20N4O3/c1-10-2-5-18(12(19)8-10)9-13(20)17-6-3-11(4-7-17)14(21)16-15/h2,5,8,11H,3-4,6-7,9,15H2,1H3,(H,16,21)
InChIKeyKLZHWFBACCADGT-UHFFFAOYSA-N
MW292.34 g/mol
LogP-0.61
Rot. Bonds3

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

1-[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide (PubChem CID 63580019) has the molecular formula C14H20N4O3 and a molecular weight of 292.34 g/mol. Its IUPAC name is 1-[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide.

Molecular Properties

Compound Name1-[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide
PubChem CID63580019
Molecular FormulaC14H20N4O3
Molecular Weight292.34 g/mol
Exact Mass292.15
IUPAC Name1-[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide
SMILESCc1ccn(CC(=O)N2CCC(C(=O)NN)CC2)c(=O)c1
InChIInChI=1S/C14H20N4O3/c1-10-2-5-18(12(19)8-10)9-13(20)17-6-3-11(4-7-17)14(21)16-15/h2,5,8,11H,3-4,6-7,9,15H2,1H3,(H,16,21)
InChIKeyKLZHWFBACCADGT-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-(4-methyl-2-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide?
The IUPAC name of 1-[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide (CID 63580019) is 1-[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide.
What is the SMILES notation for 1-[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide?
The canonical SMILES for 1-[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide is Cc1ccn(CC(=O)N2CCC(C(=O)NN)CC2)c(=O)c1.
What is the InChIKey of 1-[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide?
The InChIKey is KLZHWFBACCADGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O3/c1-10-2-5-18(12(19)8-10)9-13(20)17-6-3-11(4-7-17)14(21)16-15/h2,5,8,11H,3-4,6-7,9,15H2,1H3,(H,16,21).
What are the key properties of 1-[2-(4-methyl-2-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide?
1-[2-(4-methyl-2-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-(4-methyl-2-oxo-1-pyridinyl)acetyl]piperidine-4-carbohydrazide is sourced from PubChem (CID 63580019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).