1-[2-(4-methoxypiperidin-1-yl)acetyl]piperidine-4-carbohydrazide

C14H26N4O3 — CID 63571418

IUPAC1-[2-(4-methoxypiperidin-1-yl)acetyl]piperidine-4-carbohydrazide
SMILESCOC1CCN(CC(=O)N2CCC(C(=O)NN)CC2)CC1
InChIInChI=1S/C14H26N4O3/c1-21-12-4-6-17(7-5-12)10-13(19)18-8-2-11(3-9-18)14(20)16-15/h11-12H,2-10,15H2,1H3,(H,16,20)
InChIKeyLMAPKZRHXIPUFL-UHFFFAOYSA-N
MW298.39 g/mol
LogP-0.67
Rot. Bonds4

About 1-[2-(4-methoxypiperidin-1-yl)acetyl]piperidine-4-carbohydrazide

1-[2-(4-methoxypiperidin-1-yl)acetyl]piperidine-4-carbohydrazide (PubChem CID 63571418) has the molecular formula C14H26N4O3 and a molecular weight of 298.39 g/mol. Its IUPAC name is 1-[2-(4-methoxypiperidin-1-yl)acetyl]piperidine-4-carbohydrazide.

Molecular Properties

Compound Name1-[2-(4-methoxypiperidin-1-yl)acetyl]piperidine-4-carbohydrazide
PubChem CID63571418
Molecular FormulaC14H26N4O3
Molecular Weight298.39 g/mol
Exact Mass298.20
IUPAC Name1-[2-(4-methoxypiperidin-1-yl)acetyl]piperidine-4-carbohydrazide
SMILESCOC1CCN(CC(=O)N2CCC(C(=O)NN)CC2)CC1
InChIInChI=1S/C14H26N4O3/c1-21-12-4-6-17(7-5-12)10-13(19)18-8-2-11(3-9-18)14(20)16-15/h11-12H,2-10,15H2,1H3,(H,16,20)
InChIKeyLMAPKZRHXIPUFL-UHFFFAOYSA-N
XLogP-0.67
TPSA87.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 5-0.67
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-aminopiperidin-1-yl)acetyl]piperidine-4-carbohydrazide
CID 63578248
1-(2-morpholin-4-ylacetyl)piperidine-4-carbohydrazide
CID 63570302
ethane;1-(4-methoxypiperidin-1-yl)-2-(4-methylpiperazin-1-yl)ethanone
CID 171833651
1-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)acetyl]piperidine-4-carbohydrazide
CID 66372022
1-[2-[3-(hydroxymethyl)piperidin-1-yl]acetyl]piperidine-4-carbohydrazide
CID 63569165
1-(2-hydrazinyl-2-oxoethyl)piperidine-4-carbohydrazide
CID 3282644
methyl 1-(2-pyrrolidin-1-ylacetyl)piperidine-4-carboxylate
CID 47006242
ethane;ethyl 2-(4-methoxypiperidin-1-yl)acetate
CID 176667443
1-(2-ethoxyacetyl)piperidine-4-carbohydrazide
CID 63587204
N-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-4-carboxamide
CID 42542173
1-(2-butoxyacetyl)piperidine-4-carbohydrazide
CID 63570869
ethyl 1-[2-(4-aminopiperidin-1-yl)acetyl]piperidine-4-carboxylate
CID 79322433

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-methoxypiperidin-1-yl)acetyl]piperidine-4-carbohydrazide?
The IUPAC name of 1-[2-(4-methoxypiperidin-1-yl)acetyl]piperidine-4-carbohydrazide (CID 63571418) is 1-[2-(4-methoxypiperidin-1-yl)acetyl]piperidine-4-carbohydrazide.
What is the SMILES notation for 1-[2-(4-methoxypiperidin-1-yl)acetyl]piperidine-4-carbohydrazide?
The canonical SMILES for 1-[2-(4-methoxypiperidin-1-yl)acetyl]piperidine-4-carbohydrazide is COC1CCN(CC(=O)N2CCC(C(=O)NN)CC2)CC1.
What is the InChIKey of 1-[2-(4-methoxypiperidin-1-yl)acetyl]piperidine-4-carbohydrazide?
The InChIKey is LMAPKZRHXIPUFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O3/c1-21-12-4-6-17(7-5-12)10-13(19)18-8-2-11(3-9-18)14(20)16-15/h11-12H,2-10,15H2,1H3,(H,16,20).
What are the key properties of 1-[2-(4-methoxypiperidin-1-yl)acetyl]piperidine-4-carbohydrazide?
1-[2-(4-methoxypiperidin-1-yl)acetyl]piperidine-4-carbohydrazide has a molecular weight of 298.39 g/mol, XLogP of -0.67, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-methoxypiperidin-1-yl)acetyl]piperidine-4-carbohydrazide is sourced from PubChem (CID 63571418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).