4-(3-hydroxypiperidin-1-yl)butanehydrazide

C9H19N3O2 — CID 63585558

IUPAC4-(3-hydroxypiperidin-1-yl)butanehydrazide
SMILESNNC(=O)CCCN1CCCC(O)C1
InChIInChI=1S/C9H19N3O2/c10-11-9(14)4-2-6-12-5-1-3-8(13)7-12/h8,13H,1-7,10H2,(H,11,14)
InChIKeyRVCNDJMVKKWBBN-UHFFFAOYSA-N
MW201.27 g/mol
LogP-0.79
Rot. Bonds4

About 4-(3-hydroxypiperidin-1-yl)butanehydrazide

4-(3-hydroxypiperidin-1-yl)butanehydrazide (PubChem CID 63585558) has the molecular formula C9H19N3O2 and a molecular weight of 201.27 g/mol. Its IUPAC name is 4-(3-hydroxypiperidin-1-yl)butanehydrazide.

Molecular Properties

Compound Name4-(3-hydroxypiperidin-1-yl)butanehydrazide
PubChem CID63585558
Molecular FormulaC9H19N3O2
Molecular Weight201.27 g/mol
Exact Mass201.15
IUPAC Name4-(3-hydroxypiperidin-1-yl)butanehydrazide
SMILESNNC(=O)CCCN1CCCC(O)C1
InChIInChI=1S/C9H19N3O2/c10-11-9(14)4-2-6-12-5-1-3-8(13)7-12/h8,13H,1-7,10H2,(H,11,14)
InChIKeyRVCNDJMVKKWBBN-UHFFFAOYSA-N
XLogP-0.79
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 5-0.79
H-Bond Donors ≤ 53
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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Frequently Asked Questions

What is the IUPAC name of 4-(3-hydroxypiperidin-1-yl)butanehydrazide?
The IUPAC name of 4-(3-hydroxypiperidin-1-yl)butanehydrazide (CID 63585558) is 4-(3-hydroxypiperidin-1-yl)butanehydrazide.
What is the SMILES notation for 4-(3-hydroxypiperidin-1-yl)butanehydrazide?
The canonical SMILES for 4-(3-hydroxypiperidin-1-yl)butanehydrazide is NNC(=O)CCCN1CCCC(O)C1.
What is the InChIKey of 4-(3-hydroxypiperidin-1-yl)butanehydrazide?
The InChIKey is RVCNDJMVKKWBBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O2/c10-11-9(14)4-2-6-12-5-1-3-8(13)7-12/h8,13H,1-7,10H2,(H,11,14).
What are the key properties of 4-(3-hydroxypiperidin-1-yl)butanehydrazide?
4-(3-hydroxypiperidin-1-yl)butanehydrazide has a molecular weight of 201.27 g/mol, XLogP of -0.79, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-hydroxypiperidin-1-yl)butanehydrazide is sourced from PubChem (CID 63585558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).