1-(2-azidoethyl)piperidin-4-ol

C7H14N4O — CID 61396750

IUPAC1-(2-azidoethyl)piperidin-4-ol
SMILES[N-]=[N+]=NCCN1CCC(O)CC1
InChIInChI=1S/C7H14N4O/c8-10-9-3-6-11-4-1-7(12)2-5-11/h7,12H,1-6H2
InChIKeyREBFQZNZLSQYGI-UHFFFAOYSA-N
MW170.22 g/mol
LogP0.75
Rot. Bonds3

About 1-(2-azidoethyl)piperidin-4-ol

1-(2-azidoethyl)piperidin-4-ol (PubChem CID 61396750) has the molecular formula C7H14N4O and a molecular weight of 170.22 g/mol. Its IUPAC name is 1-(2-azidoethyl)piperidin-4-ol.

Molecular Properties

Compound Name1-(2-azidoethyl)piperidin-4-ol
PubChem CID61396750
Molecular FormulaC7H14N4O
Molecular Weight170.22 g/mol
Exact Mass170.12
IUPAC Name1-(2-azidoethyl)piperidin-4-ol
SMILES[N-]=[N+]=NCCN1CCC(O)CC1
InChIInChI=1S/C7H14N4O/c8-10-9-3-6-11-4-1-7(12)2-5-11/h7,12H,1-6H2
InChIKeyREBFQZNZLSQYGI-UHFFFAOYSA-N
XLogP0.75
TPSA72.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.22
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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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Related Compounds

1-(2-Azidoethyl)piperidin-4-ol hydrochloride
CID 132353882
1-[2-(Dimethylamino)ethyl]piperidin-4-ol
CID 52113390
(3R,4R)-3-azido-1-methylpiperidin-4-ol
CID 58177365
CID 58998271
CID 58998271
CID 59347758
CID 59347758
1-(3-Azidopropyl)piperidin-4-ol
CID 61396762
1-(4-Ethylpiperazin-1-yl)pentan-3-ol
CID 68037588
1-(4-Methylpiperazin-1-yl)pentan-3-ol
CID 91318195
1-(Azidomethyl)piperidin-4-ol
CID 118928147
1-Azidopiperidin-4-ol;hydrochloride
CID 162323360
1-[2-(Dimethylamino)ethyl]piperidin-4-ol;ethane
CID 168995585
1-Methanidylpiperidin-4-ol
CID 20756606

Frequently Asked Questions

What is the IUPAC name of 1-(2-azidoethyl)piperidin-4-ol?
The IUPAC name of 1-(2-azidoethyl)piperidin-4-ol (CID 61396750) is 1-(2-azidoethyl)piperidin-4-ol.
What is the SMILES notation for 1-(2-azidoethyl)piperidin-4-ol?
The canonical SMILES for 1-(2-azidoethyl)piperidin-4-ol is [N-]=[N+]=NCCN1CCC(O)CC1.
What is the InChIKey of 1-(2-azidoethyl)piperidin-4-ol?
The InChIKey is REBFQZNZLSQYGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N4O/c8-10-9-3-6-11-4-1-7(12)2-5-11/h7,12H,1-6H2.
What are the key properties of 1-(2-azidoethyl)piperidin-4-ol?
1-(2-azidoethyl)piperidin-4-ol has a molecular weight of 170.22 g/mol, XLogP of 0.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-azidoethyl)piperidin-4-ol is sourced from PubChem (CID 61396750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).