[(2S,5S)-5-pyridin-3-yloxolan-2-yl]methanamine

C10H14N2O — CID 155516718

IUPAC[(2S,5S)-5-pyridin-3-yloxolan-2-yl]methanamine
SMILESNC[C@@H]1CC[C@@H](c2cccnc2)O1
InChIInChI=1S/C10H14N2O/c11-6-9-3-4-10(13-9)8-2-1-5-12-7-8/h1-2,5,7,9-10H,3-4,6,11H2/t9-,10-/m0/s1
InChIKeyBZSFZSCNTDEVRV-UWVGGRQHSA-N
MW178.24 g/mol
LogP1.26
Rot. Bonds2

About [(2S,5S)-5-pyridin-3-yloxolan-2-yl]methanamine

[(2S,5S)-5-pyridin-3-yloxolan-2-yl]methanamine (PubChem CID 155516718) has the molecular formula C10H14N2O and a molecular weight of 178.24 g/mol. Its IUPAC name is [(2S,5S)-5-pyridin-3-yloxolan-2-yl]methanamine.

Molecular Properties

Compound Name[(2S,5S)-5-pyridin-3-yloxolan-2-yl]methanamine
PubChem CID155516718
Molecular FormulaC10H14N2O
Molecular Weight178.24 g/mol
Exact Mass178.11
IUPAC Name[(2S,5S)-5-pyridin-3-yloxolan-2-yl]methanamine
SMILESNC[C@@H]1CC[C@@H](c2cccnc2)O1
InChIInChI=1S/C10H14N2O/c11-6-9-3-4-10(13-9)8-2-1-5-12-7-8/h1-2,5,7,9-10H,3-4,6,11H2/t9-,10-/m0/s1
InChIKeyBZSFZSCNTDEVRV-UWVGGRQHSA-N
XLogP1.26
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(2S,5S)-5-pyridin-3-yloxolan-2-yl]methanamine?
The IUPAC name of [(2S,5S)-5-pyridin-3-yloxolan-2-yl]methanamine (CID 155516718) is [(2S,5S)-5-pyridin-3-yloxolan-2-yl]methanamine.
What is the SMILES notation for [(2S,5S)-5-pyridin-3-yloxolan-2-yl]methanamine?
The canonical SMILES for [(2S,5S)-5-pyridin-3-yloxolan-2-yl]methanamine is NC[C@@H]1CC[C@@H](c2cccnc2)O1.
What is the InChIKey of [(2S,5S)-5-pyridin-3-yloxolan-2-yl]methanamine?
The InChIKey is BZSFZSCNTDEVRV-UWVGGRQHSA-N. The full InChI is InChI=1S/C10H14N2O/c11-6-9-3-4-10(13-9)8-2-1-5-12-7-8/h1-2,5,7,9-10H,3-4,6,11H2/t9-,10-/m0/s1.
What are the key properties of [(2S,5S)-5-pyridin-3-yloxolan-2-yl]methanamine?
[(2S,5S)-5-pyridin-3-yloxolan-2-yl]methanamine has a molecular weight of 178.24 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,5S)-5-pyridin-3-yloxolan-2-yl]methanamine is sourced from PubChem (CID 155516718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).