1-(2-cyclobutyloxyacetyl)piperidine-4-carbohydrazide

C12H21N3O3 — CID 55213808

IUPAC1-(2-cyclobutyloxyacetyl)piperidine-4-carbohydrazide
SMILESNNC(=O)C1CCN(C(=O)COC2CCC2)CC1
InChIInChI=1S/C12H21N3O3/c13-14-12(17)9-4-6-15(7-5-9)11(16)8-18-10-2-1-3-10/h9-10H,1-8,13H2,(H,14,17)
InChIKeyFVQKIEFLLICJIL-UHFFFAOYSA-N
MW255.32 g/mol
LogP-0.22
Rot. Bonds4

About 1-(2-cyclobutyloxyacetyl)piperidine-4-carbohydrazide

1-(2-cyclobutyloxyacetyl)piperidine-4-carbohydrazide (PubChem CID 55213808) has the molecular formula C12H21N3O3 and a molecular weight of 255.32 g/mol. Its IUPAC name is 1-(2-cyclobutyloxyacetyl)piperidine-4-carbohydrazide.

Molecular Properties

Compound Name1-(2-cyclobutyloxyacetyl)piperidine-4-carbohydrazide
PubChem CID55213808
Molecular FormulaC12H21N3O3
Molecular Weight255.32 g/mol
Exact Mass255.16
IUPAC Name1-(2-cyclobutyloxyacetyl)piperidine-4-carbohydrazide
SMILESNNC(=O)C1CCN(C(=O)COC2CCC2)CC1
InChIInChI=1S/C12H21N3O3/c13-14-12(17)9-4-6-15(7-5-9)11(16)8-18-10-2-1-3-10/h9-10H,1-8,13H2,(H,14,17)
InChIKeyFVQKIEFLLICJIL-UHFFFAOYSA-N
XLogP-0.22
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

CID 63588699
CID 63588699
CID 66275551
CID 66275551
CID 82010143
CID 82010143
CID 82782625
CID 82782625
CID 82957360
CID 82957360
CID 59347451
CID 59347451
CID 48846410
CID 48846410
CID 55212218
CID 55212218
CID 55212610
CID 55212610
CID 63568957
CID 63568957
CID 63569456
CID 63569456
CID 63569974
CID 63569974

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclobutyloxyacetyl)piperidine-4-carbohydrazide?
The IUPAC name of 1-(2-cyclobutyloxyacetyl)piperidine-4-carbohydrazide (CID 55213808) is 1-(2-cyclobutyloxyacetyl)piperidine-4-carbohydrazide.
What is the SMILES notation for 1-(2-cyclobutyloxyacetyl)piperidine-4-carbohydrazide?
The canonical SMILES for 1-(2-cyclobutyloxyacetyl)piperidine-4-carbohydrazide is NNC(=O)C1CCN(C(=O)COC2CCC2)CC1.
What is the InChIKey of 1-(2-cyclobutyloxyacetyl)piperidine-4-carbohydrazide?
The InChIKey is FVQKIEFLLICJIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O3/c13-14-12(17)9-4-6-15(7-5-9)11(16)8-18-10-2-1-3-10/h9-10H,1-8,13H2,(H,14,17).
What are the key properties of 1-(2-cyclobutyloxyacetyl)piperidine-4-carbohydrazide?
1-(2-cyclobutyloxyacetyl)piperidine-4-carbohydrazide has a molecular weight of 255.32 g/mol, XLogP of -0.22, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclobutyloxyacetyl)piperidine-4-carbohydrazide is sourced from PubChem (CID 55213808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).