1-(2-pyrazol-1-ylacetyl)piperidine-4-carbohydrazide

C11H17N5O2 — CID 63573929

IUPAC1-(2-pyrazol-1-ylacetyl)piperidine-4-carbohydrazide
SMILESNNC(=O)C1CCN(C(=O)Cn2cccn2)CC1
InChIInChI=1S/C11H17N5O2/c12-14-11(18)9-2-6-15(7-3-9)10(17)8-16-5-1-4-13-16/h1,4-5,9H,2-3,6-8,12H2,(H,14,18)
InChIKeyQHLYFVZCQXZJDH-UHFFFAOYSA-N
MW251.29 g/mol
LogP-0.89
Rot. Bonds3

About 1-(2-pyrazol-1-ylacetyl)piperidine-4-carbohydrazide

1-(2-pyrazol-1-ylacetyl)piperidine-4-carbohydrazide (PubChem CID 63573929) has the molecular formula C11H17N5O2 and a molecular weight of 251.29 g/mol. Its IUPAC name is 1-(2-pyrazol-1-ylacetyl)piperidine-4-carbohydrazide.

Molecular Properties

Compound Name1-(2-pyrazol-1-ylacetyl)piperidine-4-carbohydrazide
PubChem CID63573929
Molecular FormulaC11H17N5O2
Molecular Weight251.29 g/mol
Exact Mass251.14
IUPAC Name1-(2-pyrazol-1-ylacetyl)piperidine-4-carbohydrazide
SMILESNNC(=O)C1CCN(C(=O)Cn2cccn2)CC1
InChIInChI=1S/C11H17N5O2/c12-14-11(18)9-2-6-15(7-3-9)10(17)8-16-5-1-4-13-16/h1,4-5,9H,2-3,6-8,12H2,(H,14,18)
InChIKeyQHLYFVZCQXZJDH-UHFFFAOYSA-N
XLogP-0.89
TPSA93.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 5-0.89
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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Related Compounds

1-[2-(4-methylpyrazol-1-yl)acetyl]piperidine-4-carbohydrazide
CID 55213875
1-[3-(azepane-1-carbonyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone
CID 110246532
1-[3-(hydroxymethyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone
CID 62349582
1-piperazin-1-yl-2-pyrazol-1-ylethanone
CID 23070038
1-[2-(4-aminopiperidin-1-yl)acetyl]piperidine-4-carbohydrazide
CID 63578248
1-[3-(methylaminomethyl)pyrrolidin-1-yl]-2-pyrazol-1-ylethanone
CID 63263322
1-(4-amino-3-methylpiperidin-1-yl)-2-pyrazol-1-ylethanone;dihydrochloride
CID 119592480
1-(2-morpholin-4-ylacetyl)piperidine-4-carbohydrazide
CID 63570302
1-(3-aminopiperidin-1-yl)-2-pyrazol-1-ylethanone;dihydrochloride
CID 119380216
1-(3-hydroxyazetidin-1-yl)-2-pyrazol-1-ylethanone
CID 63106745
1-[2-(N-methylanilino)acetyl]piperidine-4-carbohydrazide
CID 63568830
1-(4-hydroxy-4-methylpiperidin-1-yl)-2-pyrazol-1-ylethanone
CID 80707191

Frequently Asked Questions

What is the IUPAC name of 1-(2-pyrazol-1-ylacetyl)piperidine-4-carbohydrazide?
The IUPAC name of 1-(2-pyrazol-1-ylacetyl)piperidine-4-carbohydrazide (CID 63573929) is 1-(2-pyrazol-1-ylacetyl)piperidine-4-carbohydrazide.
What is the SMILES notation for 1-(2-pyrazol-1-ylacetyl)piperidine-4-carbohydrazide?
The canonical SMILES for 1-(2-pyrazol-1-ylacetyl)piperidine-4-carbohydrazide is NNC(=O)C1CCN(C(=O)Cn2cccn2)CC1.
What is the InChIKey of 1-(2-pyrazol-1-ylacetyl)piperidine-4-carbohydrazide?
The InChIKey is QHLYFVZCQXZJDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O2/c12-14-11(18)9-2-6-15(7-3-9)10(17)8-16-5-1-4-13-16/h1,4-5,9H,2-3,6-8,12H2,(H,14,18).
What are the key properties of 1-(2-pyrazol-1-ylacetyl)piperidine-4-carbohydrazide?
1-(2-pyrazol-1-ylacetyl)piperidine-4-carbohydrazide has a molecular weight of 251.29 g/mol, XLogP of -0.89, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-pyrazol-1-ylacetyl)piperidine-4-carbohydrazide is sourced from PubChem (CID 63573929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).