2-[2-(1-aminopiperidin-3-yl)oxy-3-pyridinyl]propan-2-ol

C13H21N3O2 — CID 144739553

IUPAC2-[2-(1-aminopiperidin-3-yl)oxy-3-pyridinyl]propan-2-ol
SMILESCC(C)(O)c1cccnc1OC1CCCN(N)C1
InChIInChI=1S/C13H21N3O2/c1-13(2,17)11-6-3-7-15-12(11)18-10-5-4-8-16(14)9-10/h3,6-7,10,17H,4-5,8-9,14H2,1-2H3
InChIKeyFVNOHZOJUSABJF-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.03
Rot. Bonds3

About 2-[2-(1-aminopiperidin-3-yl)oxy-3-pyridinyl]propan-2-ol

2-[2-(1-aminopiperidin-3-yl)oxy-3-pyridinyl]propan-2-ol (PubChem CID 144739553) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-[2-(1-aminopiperidin-3-yl)oxy-3-pyridinyl]propan-2-ol.

Molecular Properties

Compound Name2-[2-(1-aminopiperidin-3-yl)oxy-3-pyridinyl]propan-2-ol
PubChem CID144739553
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC Name2-[2-(1-aminopiperidin-3-yl)oxy-3-pyridinyl]propan-2-ol
SMILESCC(C)(O)c1cccnc1OC1CCCN(N)C1
InChIInChI=1S/C13H21N3O2/c1-13(2,17)11-6-3-7-15-12(11)18-10-5-4-8-16(14)9-10/h3,6-7,10,17H,4-5,8-9,14H2,1-2H3
InChIKeyFVNOHZOJUSABJF-UHFFFAOYSA-N
XLogP1.03
TPSA71.61 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Related Compounds

1-[3-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]-2-methylpropan-2-amine;hydrochloride
CID 120849833
tert-butyl (3R)-3-[(3-hydroxy-2-pyridinyl)oxy]piperidine-1-carboxylate
CID 71630690
(5-fluoro-2-pyrimidin-2-ylphenyl)-[(2R,5R)-5-[[3-(2-hydroxypropan-2-yl)-2-pyridinyl]oxy]-2-methylpiperidin-1-yl]methanone
CID 87054963
tert-butyl (3S)-3-[(3-cyano-2-pyridinyl)oxy]piperidine-1-carboxylate
CID 71630577
(1S)-1-(2-cyclopentyloxy-3-pyridinyl)ethanamine
CID 103695133
3-(1-tert-butylpiperidin-3-yl)oxy-2-methylpyridine
CID 18712952
2-cyclopentyloxy-3-fluoropyridine
CID 126955068
cyclopentyl-[3-[[3-(trifluoromethyl)-2-pyridinyl]oxy]azetidin-1-yl]methanone
CID 122250770
2-cyclopentyloxy-3-propan-2-ylpyridine
CID 164786462
[(3S)-3-[(3-fluoro-2-pyridinyl)oxy]piperidin-1-yl]-pyridazin-4-ylmethanone
CID 124738553
tert-butyl (3R)-3-[(3-bromo-2-pyridinyl)oxy]pyrrolidine-1-carboxylate
CID 97102850
[(3S)-3-[3-(dimethylamino)pyrazin-2-yl]oxypiperidin-1-yl]-thiophen-2-ylmethanone
CID 100658231

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1-aminopiperidin-3-yl)oxy-3-pyridinyl]propan-2-ol?
The IUPAC name of 2-[2-(1-aminopiperidin-3-yl)oxy-3-pyridinyl]propan-2-ol (CID 144739553) is 2-[2-(1-aminopiperidin-3-yl)oxy-3-pyridinyl]propan-2-ol.
What is the SMILES notation for 2-[2-(1-aminopiperidin-3-yl)oxy-3-pyridinyl]propan-2-ol?
The canonical SMILES for 2-[2-(1-aminopiperidin-3-yl)oxy-3-pyridinyl]propan-2-ol is CC(C)(O)c1cccnc1OC1CCCN(N)C1.
What is the InChIKey of 2-[2-(1-aminopiperidin-3-yl)oxy-3-pyridinyl]propan-2-ol?
The InChIKey is FVNOHZOJUSABJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-13(2,17)11-6-3-7-15-12(11)18-10-5-4-8-16(14)9-10/h3,6-7,10,17H,4-5,8-9,14H2,1-2H3.
What are the key properties of 2-[2-(1-aminopiperidin-3-yl)oxy-3-pyridinyl]propan-2-ol?
2-[2-(1-aminopiperidin-3-yl)oxy-3-pyridinyl]propan-2-ol has a molecular weight of 251.33 g/mol, XLogP of 1.03, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1-aminopiperidin-3-yl)oxy-3-pyridinyl]propan-2-ol is sourced from PubChem (CID 144739553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).