(2R,3S,5R)-5-(6-amino-3-pyridinyl)-2-(hydroxymethyl)oxolan-3-ol

C10H14N2O3 — CID 10465713

IUPAC(2R,3S,5R)-5-(6-amino-3-pyridinyl)-2-(hydroxymethyl)oxolan-3-ol
SMILESNc1ccc([C@H]2C[C@H](O)[C@@H](CO)O2)cn1
InChIInChI=1S/C10H14N2O3/c11-10-2-1-6(4-12-10)8-3-7(14)9(5-13)15-8/h1-2,4,7-9,13-14H,3,5H2,(H2,11,12)/t7-,8+,9+/m0/s1
InChIKeyBZZXTMQMTANUFV-DJLDLDEBSA-N
MW210.23 g/mol
LogP-0.15
Rot. Bonds2

About (2R,3S,5R)-5-(6-amino-3-pyridinyl)-2-(hydroxymethyl)oxolan-3-ol

(2R,3S,5R)-5-(6-amino-3-pyridinyl)-2-(hydroxymethyl)oxolan-3-ol (PubChem CID 10465713) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is (2R,3S,5R)-5-(6-amino-3-pyridinyl)-2-(hydroxymethyl)oxolan-3-ol.

Molecular Properties

Compound Name(2R,3S,5R)-5-(6-amino-3-pyridinyl)-2-(hydroxymethyl)oxolan-3-ol
PubChem CID10465713
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name(2R,3S,5R)-5-(6-amino-3-pyridinyl)-2-(hydroxymethyl)oxolan-3-ol
SMILESNc1ccc([C@H]2C[C@H](O)[C@@H](CO)O2)cn1
InChIInChI=1S/C10H14N2O3/c11-10-2-1-6(4-12-10)8-3-7(14)9(5-13)15-8/h1-2,4,7-9,13-14H,3,5H2,(H2,11,12)/t7-,8+,9+/m0/s1
InChIKeyBZZXTMQMTANUFV-DJLDLDEBSA-N
XLogP-0.15
TPSA88.60 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 5-0.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2R,3S,5R)-5-(6-amino-3-pyridinyl)-2-(hydroxymethyl)oxolan-3-ol?
The IUPAC name of (2R,3S,5R)-5-(6-amino-3-pyridinyl)-2-(hydroxymethyl)oxolan-3-ol (CID 10465713) is (2R,3S,5R)-5-(6-amino-3-pyridinyl)-2-(hydroxymethyl)oxolan-3-ol.
What is the SMILES notation for (2R,3S,5R)-5-(6-amino-3-pyridinyl)-2-(hydroxymethyl)oxolan-3-ol?
The canonical SMILES for (2R,3S,5R)-5-(6-amino-3-pyridinyl)-2-(hydroxymethyl)oxolan-3-ol is Nc1ccc([C@H]2C[C@H](O)[C@@H](CO)O2)cn1.
What is the InChIKey of (2R,3S,5R)-5-(6-amino-3-pyridinyl)-2-(hydroxymethyl)oxolan-3-ol?
The InChIKey is BZZXTMQMTANUFV-DJLDLDEBSA-N. The full InChI is InChI=1S/C10H14N2O3/c11-10-2-1-6(4-12-10)8-3-7(14)9(5-13)15-8/h1-2,4,7-9,13-14H,3,5H2,(H2,11,12)/t7-,8+,9+/m0/s1.
What are the key properties of (2R,3S,5R)-5-(6-amino-3-pyridinyl)-2-(hydroxymethyl)oxolan-3-ol?
(2R,3S,5R)-5-(6-amino-3-pyridinyl)-2-(hydroxymethyl)oxolan-3-ol has a molecular weight of 210.23 g/mol, XLogP of -0.15, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S,5R)-5-(6-amino-3-pyridinyl)-2-(hydroxymethyl)oxolan-3-ol is sourced from PubChem (CID 10465713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).