(2S,3S)-2-pyridin-3-yloxolan-3-amine

C9H12N2O — CID 124511858

IUPAC(2S,3S)-2-pyridin-3-yloxolan-3-amine
SMILESN[C@H]1CCO[C@H]1c1cccnc1
InChIInChI=1S/C9H12N2O/c10-8-3-5-12-9(8)7-2-1-4-11-6-7/h1-2,4,6,8-9H,3,5,10H2/t8-,9-/m0/s1
InChIKeyLYPUGHDFPYWKIG-IUCAKERBSA-N
MW164.21 g/mol
LogP0.87
Rot. Bonds1

About (2S,3S)-2-pyridin-3-yloxolan-3-amine

(2S,3S)-2-pyridin-3-yloxolan-3-amine (PubChem CID 124511858) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is (2S,3S)-2-pyridin-3-yloxolan-3-amine.

Molecular Properties

Compound Name(2S,3S)-2-pyridin-3-yloxolan-3-amine
PubChem CID124511858
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name(2S,3S)-2-pyridin-3-yloxolan-3-amine
SMILESN[C@H]1CCO[C@H]1c1cccnc1
InChIInChI=1S/C9H12N2O/c10-8-3-5-12-9(8)7-2-1-4-11-6-7/h1-2,4,6,8-9H,3,5,10H2/t8-,9-/m0/s1
InChIKeyLYPUGHDFPYWKIG-IUCAKERBSA-N
XLogP0.87
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R,3S)-2-pyridin-4-yloxolan-3-amine
CID 119032003
(2R,3R)-2-pyridin-4-yloxolan-3-amine
CID 124708910
2-(5-bromo-3-pyridinyl)oxolan-3-amine;dihydrochloride
CID 122236370
2-methoxy-N-[(2-pyridin-3-yloxolan-3-yl)methyl]ethanamine
CID 79365253
(2S,3R)-2-[5-(3-cyclobutylphenyl)-3-pyridinyl]oxolan-3-amine
CID 138045902
(2R,3R)-2-pyridin-4-yloxan-3-amine
CID 124709129
N-[(2R,3S)-2-pyridin-3-yloxolan-3-yl]oxane-2-carboxamide
CID 127265241
2-(3-chlorophenyl)oxolan-3-amine
CID 79364588
4-methyl-2-pyridin-3-ylcyclohexan-1-amine
CID 81013157
2-[5-(2-fluorophenyl)-3-pyridinyl]oxolan-3-amine;dihydrochloride
CID 172642974
3-[3-(3,5-dipyridin-3-ylcyclohexyl)-5-pyridin-3-ylcyclohexyl]pyridine
CID 58652188
2-methoxy-N-[(2-pyridin-3-yloxan-3-yl)methyl]ethanamine
CID 79365670

Frequently Asked Questions

What is the IUPAC name of (2S,3S)-2-pyridin-3-yloxolan-3-amine?
The IUPAC name of (2S,3S)-2-pyridin-3-yloxolan-3-amine (CID 124511858) is (2S,3S)-2-pyridin-3-yloxolan-3-amine.
What is the SMILES notation for (2S,3S)-2-pyridin-3-yloxolan-3-amine?
The canonical SMILES for (2S,3S)-2-pyridin-3-yloxolan-3-amine is N[C@H]1CCO[C@H]1c1cccnc1.
What is the InChIKey of (2S,3S)-2-pyridin-3-yloxolan-3-amine?
The InChIKey is LYPUGHDFPYWKIG-IUCAKERBSA-N. The full InChI is InChI=1S/C9H12N2O/c10-8-3-5-12-9(8)7-2-1-4-11-6-7/h1-2,4,6,8-9H,3,5,10H2/t8-,9-/m0/s1.
What are the key properties of (2S,3S)-2-pyridin-3-yloxolan-3-amine?
(2S,3S)-2-pyridin-3-yloxolan-3-amine has a molecular weight of 164.21 g/mol, XLogP of 0.87, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S)-2-pyridin-3-yloxolan-3-amine is sourced from PubChem (CID 124511858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).