2-(4-methoxypiperidin-1-yl)-3-methylbutanehydrazide

C11H23N3O2 — CID 63574228

IUPAC2-(4-methoxypiperidin-1-yl)-3-methylbutanehydrazide
SMILESCOC1CCN(C(C(=O)NN)C(C)C)CC1
InChIInChI=1S/C11H23N3O2/c1-8(2)10(11(15)13-12)14-6-4-9(16-3)5-7-14/h8-10H,4-7,12H2,1-3H3,(H,13,15)
InChIKeyWGCNFWWPDJVRLY-UHFFFAOYSA-N
MW229.32 g/mol
LogP0.11
Rot. Bonds4

About 2-(4-methoxypiperidin-1-yl)-3-methylbutanehydrazide

2-(4-methoxypiperidin-1-yl)-3-methylbutanehydrazide (PubChem CID 63574228) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 2-(4-methoxypiperidin-1-yl)-3-methylbutanehydrazide.

Molecular Properties

Compound Name2-(4-methoxypiperidin-1-yl)-3-methylbutanehydrazide
PubChem CID63574228
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name2-(4-methoxypiperidin-1-yl)-3-methylbutanehydrazide
SMILESCOC1CCN(C(C(=O)NN)C(C)C)CC1
InChIInChI=1S/C11H23N3O2/c1-8(2)10(11(15)13-12)14-6-4-9(16-3)5-7-14/h8-10H,4-7,12H2,1-3H3,(H,13,15)
InChIKeyWGCNFWWPDJVRLY-UHFFFAOYSA-N
XLogP0.11
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
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

3-methyl-2-(4-methylpiperidin-1-yl)butanehydrazide
CID 43906589
3-methyl-2-(3-methylpyrrolidin-1-yl)butanehydrazide
CID 63572855
(2R)-3-methyl-2-morpholin-4-ylbutanehydrazide
CID 30403760
3-methyl-2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)butanehydrazide
CID 63573609
2-(4,4-diethylpiperidin-1-yl)-3-methylbutanehydrazide
CID 55212673
methyl 3-methyl-2-pyrrolidin-1-ylbutanoate
CID 43866498
(2R)-3-methyl-2-(4-phenylpiperazin-1-yl)butanehydrazide
CID 30403786
(2S)-2-amino-1-(4-methoxypiperidin-1-yl)-3-methylbutan-1-one
CID 61155723
(2R)-2-amino-1-(4-methoxypiperidin-1-yl)-3-methylbutan-1-one
CID 79011459
4-(4-methoxypiperidin-1-yl)pentan-2-one
CID 64699120
3-methyl-2-(2-methyl-1,4-oxazepan-4-yl)butanehydrazide
CID 63583173
2-methoxy-1-(4-methoxypiperidin-1-yl)propan-1-one
CID 77474038

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxypiperidin-1-yl)-3-methylbutanehydrazide?
The IUPAC name of 2-(4-methoxypiperidin-1-yl)-3-methylbutanehydrazide (CID 63574228) is 2-(4-methoxypiperidin-1-yl)-3-methylbutanehydrazide.
What is the SMILES notation for 2-(4-methoxypiperidin-1-yl)-3-methylbutanehydrazide?
The canonical SMILES for 2-(4-methoxypiperidin-1-yl)-3-methylbutanehydrazide is COC1CCN(C(C(=O)NN)C(C)C)CC1.
What is the InChIKey of 2-(4-methoxypiperidin-1-yl)-3-methylbutanehydrazide?
The InChIKey is WGCNFWWPDJVRLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-8(2)10(11(15)13-12)14-6-4-9(16-3)5-7-14/h8-10H,4-7,12H2,1-3H3,(H,13,15).
What are the key properties of 2-(4-methoxypiperidin-1-yl)-3-methylbutanehydrazide?
2-(4-methoxypiperidin-1-yl)-3-methylbutanehydrazide has a molecular weight of 229.32 g/mol, XLogP of 0.11, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxypiperidin-1-yl)-3-methylbutanehydrazide is sourced from PubChem (CID 63574228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).