N'-(2-oxo-2-piperidin-1-ylacetyl)benzohydrazide

C14H17N3O3 — CID 3121380

IUPACN'-(2-oxo-2-piperidin-1-ylacetyl)benzohydrazide
SMILESO=C(NNC(=O)c1ccccc1)C(=O)N1CCCCC1
InChIInChI=1S/C14H17N3O3/c18-12(11-7-3-1-4-8-11)15-16-13(19)14(20)17-9-5-2-6-10-17/h1,3-4,7-8H,2,5-6,9-10H2,(H,15,18)(H,16,19)
InChIKeyFZDIYWKYTDGQLE-UHFFFAOYSA-N
MW275.31 g/mol
LogP0.46
Rot. Bonds1

About N'-(2-oxo-2-piperidin-1-ylacetyl)benzohydrazide

N'-(2-oxo-2-piperidin-1-ylacetyl)benzohydrazide (PubChem CID 3121380) has the molecular formula C14H17N3O3 and a molecular weight of 275.31 g/mol. Its IUPAC name is N'-(2-oxo-2-piperidin-1-ylacetyl)benzohydrazide.

Molecular Properties

Compound NameN'-(2-oxo-2-piperidin-1-ylacetyl)benzohydrazide
PubChem CID3121380
Molecular FormulaC14H17N3O3
Molecular Weight275.31 g/mol
Exact Mass275.13
IUPAC NameN'-(2-oxo-2-piperidin-1-ylacetyl)benzohydrazide
SMILESO=C(NNC(=O)c1ccccc1)C(=O)N1CCCCC1
InChIInChI=1S/C14H17N3O3/c18-12(11-7-3-1-4-8-11)15-16-13(19)14(20)17-9-5-2-6-10-17/h1,3-4,7-8H,2,5-6,9-10H2,(H,15,18)(H,16,19)
InChIKeyFZDIYWKYTDGQLE-UHFFFAOYSA-N
XLogP0.46
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', '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 N'-(2-oxo-2-piperidin-1-ylacetyl)benzohydrazide?
The IUPAC name of N'-(2-oxo-2-piperidin-1-ylacetyl)benzohydrazide (CID 3121380) is N'-(2-oxo-2-piperidin-1-ylacetyl)benzohydrazide.
What is the SMILES notation for N'-(2-oxo-2-piperidin-1-ylacetyl)benzohydrazide?
The canonical SMILES for N'-(2-oxo-2-piperidin-1-ylacetyl)benzohydrazide is O=C(NNC(=O)c1ccccc1)C(=O)N1CCCCC1.
What is the InChIKey of N'-(2-oxo-2-piperidin-1-ylacetyl)benzohydrazide?
The InChIKey is FZDIYWKYTDGQLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3/c18-12(11-7-3-1-4-8-11)15-16-13(19)14(20)17-9-5-2-6-10-17/h1,3-4,7-8H,2,5-6,9-10H2,(H,15,18)(H,16,19).
What are the key properties of N'-(2-oxo-2-piperidin-1-ylacetyl)benzohydrazide?
N'-(2-oxo-2-piperidin-1-ylacetyl)benzohydrazide has a molecular weight of 275.31 g/mol, XLogP of 0.46, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-oxo-2-piperidin-1-ylacetyl)benzohydrazide is sourced from PubChem (CID 3121380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).