4-hydroxypiperidine-1-carbohydrazide

C6H13N3O2 — CID 43164070

IUPAC4-hydroxypiperidine-1-carbohydrazide
SMILESNNC(=O)N1CCC(O)CC1
InChIInChI=1S/C6H13N3O2/c7-8-6(11)9-3-1-5(10)2-4-9/h5,10H,1-4,7H2,(H,8,11)
InChIKeyKETXTFVQMMRVAD-UHFFFAOYSA-N
MW159.19 g/mol
LogP-0.97
Rot. Bonds

About 4-hydroxypiperidine-1-carbohydrazide

4-hydroxypiperidine-1-carbohydrazide (PubChem CID 43164070) has the molecular formula C6H13N3O2 and a molecular weight of 159.19 g/mol. Its IUPAC name is 4-hydroxypiperidine-1-carbohydrazide.

Molecular Properties

Compound Name4-hydroxypiperidine-1-carbohydrazide
PubChem CID43164070
Molecular FormulaC6H13N3O2
Molecular Weight159.19 g/mol
Exact Mass159.10
IUPAC Name4-hydroxypiperidine-1-carbohydrazide
SMILESNNC(=O)N1CCC(O)CC1
InChIInChI=1S/C6H13N3O2/c7-8-6(11)9-3-1-5(10)2-4-9/h5,10H,1-4,7H2,(H,8,11)
InChIKeyKETXTFVQMMRVAD-UHFFFAOYSA-N
XLogP-0.97
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.19
LogP ≤ 5-0.97
H-Bond Donors ≤ 53
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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Frequently Asked Questions

What is the IUPAC name of 4-hydroxypiperidine-1-carbohydrazide?
The IUPAC name of 4-hydroxypiperidine-1-carbohydrazide (CID 43164070) is 4-hydroxypiperidine-1-carbohydrazide.
What is the SMILES notation for 4-hydroxypiperidine-1-carbohydrazide?
The canonical SMILES for 4-hydroxypiperidine-1-carbohydrazide is NNC(=O)N1CCC(O)CC1.
What is the InChIKey of 4-hydroxypiperidine-1-carbohydrazide?
The InChIKey is KETXTFVQMMRVAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3O2/c7-8-6(11)9-3-1-5(10)2-4-9/h5,10H,1-4,7H2,(H,8,11).
What are the key properties of 4-hydroxypiperidine-1-carbohydrazide?
4-hydroxypiperidine-1-carbohydrazide has a molecular weight of 159.19 g/mol, XLogP of -0.97, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxypiperidine-1-carbohydrazide is sourced from PubChem (CID 43164070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).