4-[3-(methoxymethyl)piperidin-1-yl]butanehydrazide

C11H23N3O2 — CID 106589698

IUPAC4-[3-(methoxymethyl)piperidin-1-yl]butanehydrazide
SMILESCOCC1CCCN(CCCC(=O)NN)C1
InChIInChI=1S/C11H23N3O2/c1-16-9-10-4-2-6-14(8-10)7-3-5-11(15)13-12/h10H,2-9,12H2,1H3,(H,13,15)
InChIKeyQQPBOZRLSRCCCA-UHFFFAOYSA-N
MW229.32 g/mol
LogP0.11
Rot. Bonds6

About 4-[3-(methoxymethyl)piperidin-1-yl]butanehydrazide

4-[3-(methoxymethyl)piperidin-1-yl]butanehydrazide (PubChem CID 106589698) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 4-[3-(methoxymethyl)piperidin-1-yl]butanehydrazide.

Molecular Properties

Compound Name4-[3-(methoxymethyl)piperidin-1-yl]butanehydrazide
PubChem CID106589698
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name4-[3-(methoxymethyl)piperidin-1-yl]butanehydrazide
SMILESCOCC1CCCN(CCCC(=O)NN)C1
InChIInChI=1S/C11H23N3O2/c1-16-9-10-4-2-6-14(8-10)7-3-5-11(15)13-12/h10H,2-9,12H2,1H3,(H,13,15)
InChIKeyQQPBOZRLSRCCCA-UHFFFAOYSA-N
XLogP0.11
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 50.11
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

4-(3-methoxypiperidin-1-yl)butanehydrazide
CID 102968724
4-(3-hydroxypiperidin-1-yl)butanehydrazide
CID 63585558
6-[3-(methoxymethyl)piperidin-1-yl]hexan-1-amine
CID 106587405
N'-hydroxy-4-[3-(methoxymethyl)piperidin-1-yl]butanimidamide
CID 106587066
4-(4-methylazepan-1-yl)butanehydrazide
CID 63627733
6-[3-(methoxymethyl)piperidin-1-yl]hexane-1-thiol
CID 106590054
1-(3-bromopropyl)-3-(methoxymethyl)piperidine
CID 106588360
5-(3-methoxypyrrolidin-1-yl)pentanehydrazide
CID 103540509
5-[3-(methoxymethyl)piperidin-1-yl]pentan-2-ol
CID 103274720
5-[3-(methoxymethyl)piperidin-1-yl]-2-methyl-2-(propylamino)pentanamide
CID 106588668
5-[3-(methoxymethyl)piperidin-1-yl]-2-methyl-2-(propylamino)pentanoic acid
CID 106588666
5-[3-(methoxymethyl)piperidin-1-yl]-2-methylpentan-2-amine
CID 106587473

Frequently Asked Questions

What is the IUPAC name of 4-[3-(methoxymethyl)piperidin-1-yl]butanehydrazide?
The IUPAC name of 4-[3-(methoxymethyl)piperidin-1-yl]butanehydrazide (CID 106589698) is 4-[3-(methoxymethyl)piperidin-1-yl]butanehydrazide.
What is the SMILES notation for 4-[3-(methoxymethyl)piperidin-1-yl]butanehydrazide?
The canonical SMILES for 4-[3-(methoxymethyl)piperidin-1-yl]butanehydrazide is COCC1CCCN(CCCC(=O)NN)C1.
What is the InChIKey of 4-[3-(methoxymethyl)piperidin-1-yl]butanehydrazide?
The InChIKey is QQPBOZRLSRCCCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-16-9-10-4-2-6-14(8-10)7-3-5-11(15)13-12/h10H,2-9,12H2,1H3,(H,13,15).
What are the key properties of 4-[3-(methoxymethyl)piperidin-1-yl]butanehydrazide?
4-[3-(methoxymethyl)piperidin-1-yl]butanehydrazide has a molecular weight of 229.32 g/mol, XLogP of 0.11, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(methoxymethyl)piperidin-1-yl]butanehydrazide is sourced from PubChem (CID 106589698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).