(2R)-1-(2-ethylpiperidin-1-yl)-3-(methyldiazenyl)propan-2-ol

C11H23N3O — CID 67565871

IUPAC(2R)-1-(2-ethylpiperidin-1-yl)-3-(methyldiazenyl)propan-2-ol
SMILESCCC1CCCCN1C[C@@H](O)C/N=N/C
InChIInChI=1S/C11H23N3O/c1-3-10-6-4-5-7-14(10)9-11(15)8-13-12-2/h10-11,15H,3-9H2,1-2H3/b13-12+/t10?,11-/m0/s1
InChIKeyOMRZKFYDLHVMIW-INKUDVKGSA-N
MW213.32 g/mol
LogP1.69
Rot. Bonds5

About (2R)-1-(2-ethylpiperidin-1-yl)-3-(methyldiazenyl)propan-2-ol

(2R)-1-(2-ethylpiperidin-1-yl)-3-(methyldiazenyl)propan-2-ol (PubChem CID 67565871) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is (2R)-1-(2-ethylpiperidin-1-yl)-3-(methyldiazenyl)propan-2-ol.

Molecular Properties

Compound Name(2R)-1-(2-ethylpiperidin-1-yl)-3-(methyldiazenyl)propan-2-ol
PubChem CID67565871
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name(2R)-1-(2-ethylpiperidin-1-yl)-3-(methyldiazenyl)propan-2-ol
SMILESCCC1CCCCN1C[C@@H](O)C/N=N/C
InChIInChI=1S/C11H23N3O/c1-3-10-6-4-5-7-14(10)9-11(15)8-13-12-2/h10-11,15H,3-9H2,1-2H3/b13-12+/t10?,11-/m0/s1
InChIKeyOMRZKFYDLHVMIW-INKUDVKGSA-N
XLogP1.69
TPSA48.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-chloro-3-(2-ethylazepan-1-yl)propan-2-ol
CID 104691333
1-(2-ethylpiperidin-1-yl)-3-(propylamino)propan-2-ol
CID 43266432
1-(2-ethylpiperidin-1-yl)-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 106991719
1-butoxy-3-(2-ethylazepan-1-yl)propan-2-ol
CID 107263966
1-[2-(2-hydroxypropyl)piperidin-1-yl]butan-2-ol
CID 114337983
1-(2-ethylazepan-1-yl)-3-(2-methoxyethylamino)propan-2-ol
CID 113441633
1,2-diethylpiperidine
CID 19604037
1-cyclohexyl-2-(2-ethylpiperidin-1-yl)ethanamine
CID 113448010
1-(2-ethylpyrrolidin-1-yl)-3-(2-methoxyethoxy)propan-2-ol
CID 106991786
methyl 2-bromo-3-(2-ethylpiperidin-1-yl)propanoate
CID 81100236
1-ethoxy-3-[2-(hydroxymethyl)piperidin-1-yl]propan-2-ol
CID 63932738
(2R)-3-(2-ethylpyrrolidin-1-yl)-2-hydroxypropanamide
CID 69367604

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(2-ethylpiperidin-1-yl)-3-(methyldiazenyl)propan-2-ol?
The IUPAC name of (2R)-1-(2-ethylpiperidin-1-yl)-3-(methyldiazenyl)propan-2-ol (CID 67565871) is (2R)-1-(2-ethylpiperidin-1-yl)-3-(methyldiazenyl)propan-2-ol.
What is the SMILES notation for (2R)-1-(2-ethylpiperidin-1-yl)-3-(methyldiazenyl)propan-2-ol?
The canonical SMILES for (2R)-1-(2-ethylpiperidin-1-yl)-3-(methyldiazenyl)propan-2-ol is CCC1CCCCN1C[C@@H](O)C/N=N/C.
What is the InChIKey of (2R)-1-(2-ethylpiperidin-1-yl)-3-(methyldiazenyl)propan-2-ol?
The InChIKey is OMRZKFYDLHVMIW-INKUDVKGSA-N. The full InChI is InChI=1S/C11H23N3O/c1-3-10-6-4-5-7-14(10)9-11(15)8-13-12-2/h10-11,15H,3-9H2,1-2H3/b13-12+/t10?,11-/m0/s1.
What are the key properties of (2R)-1-(2-ethylpiperidin-1-yl)-3-(methyldiazenyl)propan-2-ol?
(2R)-1-(2-ethylpiperidin-1-yl)-3-(methyldiazenyl)propan-2-ol has a molecular weight of 213.32 g/mol, XLogP of 1.69, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(2-ethylpiperidin-1-yl)-3-(methyldiazenyl)propan-2-ol is sourced from PubChem (CID 67565871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).