5-(3-methyl-2-oxo-1-pyridinyl)pentanehydrazide

C11H17N3O2 — CID 63579418

IUPAC5-(3-methyl-2-oxo-1-pyridinyl)pentanehydrazide
SMILESCc1cccn(CCCCC(=O)NN)c1=O
InChIInChI=1S/C11H17N3O2/c1-9-5-4-8-14(11(9)16)7-3-2-6-10(15)13-12/h4-5,8H,2-3,6-7,12H2,1H3,(H,13,15)
InChIKeyNVGCIQHOABDHJQ-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.32
Rot. Bonds5

About 5-(3-methyl-2-oxo-1-pyridinyl)pentanehydrazide

5-(3-methyl-2-oxo-1-pyridinyl)pentanehydrazide (PubChem CID 63579418) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 5-(3-methyl-2-oxo-1-pyridinyl)pentanehydrazide.

Molecular Properties

Compound Name5-(3-methyl-2-oxo-1-pyridinyl)pentanehydrazide
PubChem CID63579418
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name5-(3-methyl-2-oxo-1-pyridinyl)pentanehydrazide
SMILESCc1cccn(CCCCC(=O)NN)c1=O
InChIInChI=1S/C11H17N3O2/c1-9-5-4-8-14(11(9)16)7-3-2-6-10(15)13-12/h4-5,8H,2-3,6-7,12H2,1H3,(H,13,15)
InChIKeyNVGCIQHOABDHJQ-UHFFFAOYSA-N
XLogP0.32
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', '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 5-(3-methyl-2-oxo-1-pyridinyl)pentanehydrazide?
The IUPAC name of 5-(3-methyl-2-oxo-1-pyridinyl)pentanehydrazide (CID 63579418) is 5-(3-methyl-2-oxo-1-pyridinyl)pentanehydrazide.
What is the SMILES notation for 5-(3-methyl-2-oxo-1-pyridinyl)pentanehydrazide?
The canonical SMILES for 5-(3-methyl-2-oxo-1-pyridinyl)pentanehydrazide is Cc1cccn(CCCCC(=O)NN)c1=O.
What is the InChIKey of 5-(3-methyl-2-oxo-1-pyridinyl)pentanehydrazide?
The InChIKey is NVGCIQHOABDHJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-9-5-4-8-14(11(9)16)7-3-2-6-10(15)13-12/h4-5,8H,2-3,6-7,12H2,1H3,(H,13,15).
What are the key properties of 5-(3-methyl-2-oxo-1-pyridinyl)pentanehydrazide?
5-(3-methyl-2-oxo-1-pyridinyl)pentanehydrazide has a molecular weight of 223.28 g/mol, XLogP of 0.32, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methyl-2-oxo-1-pyridinyl)pentanehydrazide is sourced from PubChem (CID 63579418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).