4-(4,4-diethylpiperidin-1-yl)butanehydrazide

C13H27N3O — CID 63583162

IUPAC4-(4,4-diethylpiperidin-1-yl)butanehydrazide
SMILESCCC1(CC)CCN(CCCC(=O)NN)CC1
InChIInChI=1S/C13H27N3O/c1-3-13(4-2)7-10-16(11-8-13)9-5-6-12(17)15-14/h3-11,14H2,1-2H3,(H,15,17)
InChIKeyQKRFFHOQIQBDSJ-UHFFFAOYSA-N
MW241.38 g/mol
LogP1.66
Rot. Bonds6

About 4-(4,4-diethylpiperidin-1-yl)butanehydrazide

4-(4,4-diethylpiperidin-1-yl)butanehydrazide (PubChem CID 63583162) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is 4-(4,4-diethylpiperidin-1-yl)butanehydrazide.

Molecular Properties

Compound Name4-(4,4-diethylpiperidin-1-yl)butanehydrazide
PubChem CID63583162
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC Name4-(4,4-diethylpiperidin-1-yl)butanehydrazide
SMILESCCC1(CC)CCN(CCCC(=O)NN)CC1
InChIInChI=1S/C13H27N3O/c1-3-13(4-2)7-10-16(11-8-13)9-5-6-12(17)15-14/h3-11,14H2,1-2H3,(H,15,17)
InChIKeyQKRFFHOQIQBDSJ-UHFFFAOYSA-N
XLogP1.66
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

5-(4-propylpiperazin-1-yl)pentanehydrazide
CID 63568646
3-(4,4-dimethylpiperidin-1-yl)propanehydrazide
CID 63573423
4-[4-(2-methylpropyl)piperazin-1-yl]butanehydrazide
CID 63571513
7-(4,4-diethylpiperidin-1-yl)heptan-1-amine
CID 55159303
1-(4-hydrazinyl-4-oxobutyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 114173352
5-(4-ethylpiperidin-1-yl)pentanehydrazide
CID 63578403
5-morpholin-4-ylpentanehydrazide
CID 63570305
4-(4-methylazepan-1-yl)butanehydrazide
CID 63627733
1-(4-hydrazinyl-4-oxobutyl)-N-methylpiperidine-4-carboxamide
CID 63584988
1-(9-bromononyl)-4,4-diethylpiperidine
CID 105343769
3-(4,4-diethylpiperidin-1-yl)propane-1-sulfonamide
CID 112594762
5-(4-hydroxypiperidin-1-yl)pentanehydrazide
CID 63571141

Frequently Asked Questions

What is the IUPAC name of 4-(4,4-diethylpiperidin-1-yl)butanehydrazide?
The IUPAC name of 4-(4,4-diethylpiperidin-1-yl)butanehydrazide (CID 63583162) is 4-(4,4-diethylpiperidin-1-yl)butanehydrazide.
What is the SMILES notation for 4-(4,4-diethylpiperidin-1-yl)butanehydrazide?
The canonical SMILES for 4-(4,4-diethylpiperidin-1-yl)butanehydrazide is CCC1(CC)CCN(CCCC(=O)NN)CC1.
What is the InChIKey of 4-(4,4-diethylpiperidin-1-yl)butanehydrazide?
The InChIKey is QKRFFHOQIQBDSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-3-13(4-2)7-10-16(11-8-13)9-5-6-12(17)15-14/h3-11,14H2,1-2H3,(H,15,17).
What are the key properties of 4-(4,4-diethylpiperidin-1-yl)butanehydrazide?
4-(4,4-diethylpiperidin-1-yl)butanehydrazide has a molecular weight of 241.38 g/mol, XLogP of 1.66, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,4-diethylpiperidin-1-yl)butanehydrazide is sourced from PubChem (CID 63583162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).