1-azidopiperidin-4-ol;hydrochloride

C5H11ClN4O — CID 162323360

IUPAC1-azidopiperidin-4-ol;hydrochloride
SMILESCl.[N-]=[N+]=NN1CCC(O)CC1
InChIInChI=1S/C5H10N4O.ClH/c6-7-8-9-3-1-5(10)2-4-9;/h5,10H,1-4H2;1H
InChIKeyMCITYMOCOWHRNY-UHFFFAOYSA-N
MW178.62 g/mol
LogP1.09
Rot. Bonds1

About 1-azidopiperidin-4-ol;hydrochloride

1-azidopiperidin-4-ol;hydrochloride (PubChem CID 162323360) has the molecular formula C5H11ClN4O and a molecular weight of 178.62 g/mol. Its IUPAC name is 1-azidopiperidin-4-ol;hydrochloride.

Molecular Properties

Compound Name1-azidopiperidin-4-ol;hydrochloride
PubChem CID162323360
Molecular FormulaC5H11ClN4O
Molecular Weight178.62 g/mol
Exact Mass178.06
IUPAC Name1-azidopiperidin-4-ol;hydrochloride
SMILESCl.[N-]=[N+]=NN1CCC(O)CC1
InChIInChI=1S/C5H10N4O.ClH/c6-7-8-9-3-1-5(10)2-4-9;/h5,10H,1-4H2;1H
InChIKeyMCITYMOCOWHRNY-UHFFFAOYSA-N
XLogP1.09
TPSA72.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.62
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-azidopiperidin-4-ol;hydrochloride?
The IUPAC name of 1-azidopiperidin-4-ol;hydrochloride (CID 162323360) is 1-azidopiperidin-4-ol;hydrochloride.
What is the SMILES notation for 1-azidopiperidin-4-ol;hydrochloride?
The canonical SMILES for 1-azidopiperidin-4-ol;hydrochloride is Cl.[N-]=[N+]=NN1CCC(O)CC1.
What is the InChIKey of 1-azidopiperidin-4-ol;hydrochloride?
The InChIKey is MCITYMOCOWHRNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N4O.ClH/c6-7-8-9-3-1-5(10)2-4-9;/h5,10H,1-4H2;1H.
What are the key properties of 1-azidopiperidin-4-ol;hydrochloride?
1-azidopiperidin-4-ol;hydrochloride has a molecular weight of 178.62 g/mol, XLogP of 1.09, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-azidopiperidin-4-ol;hydrochloride is sourced from PubChem (CID 162323360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).