3-(7-methoxyfuro[2,3-c]pyridin-2-yl)oxolan-3-ol

C12H13NO4 — CID 22112793

IUPAC3-(7-methoxyfuro[2,3-c]pyridin-2-yl)oxolan-3-ol
SMILESCOc1nccc2cc(C3(O)CCOC3)oc12
InChIInChI=1S/C12H13NO4/c1-15-11-10-8(2-4-13-11)6-9(17-10)12(14)3-5-16-7-12/h2,4,6,14H,3,5,7H2,1H3
InChIKeyKULMYOIAOYZBKP-UHFFFAOYSA-N
MW235.24 g/mol
LogP1.44
Rot. Bonds2

About 3-(7-methoxyfuro[2,3-c]pyridin-2-yl)oxolan-3-ol

3-(7-methoxyfuro[2,3-c]pyridin-2-yl)oxolan-3-ol (PubChem CID 22112793) has the molecular formula C12H13NO4 and a molecular weight of 235.24 g/mol. Its IUPAC name is 3-(7-methoxyfuro[2,3-c]pyridin-2-yl)oxolan-3-ol.

Molecular Properties

Compound Name3-(7-methoxyfuro[2,3-c]pyridin-2-yl)oxolan-3-ol
PubChem CID22112793
Molecular FormulaC12H13NO4
Molecular Weight235.24 g/mol
Exact Mass235.08
IUPAC Name3-(7-methoxyfuro[2,3-c]pyridin-2-yl)oxolan-3-ol
SMILESCOc1nccc2cc(C3(O)CCOC3)oc12
InChIInChI=1S/C12H13NO4/c1-15-11-10-8(2-4-13-11)6-9(17-10)12(14)3-5-16-7-12/h2,4,6,14H,3,5,7H2,1H3
InChIKeyKULMYOIAOYZBKP-UHFFFAOYSA-N
XLogP1.44
TPSA64.72 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.24
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(7-methoxyfuro[2,3-c]pyridin-2-yl)oxolan-3-ol?
The IUPAC name of 3-(7-methoxyfuro[2,3-c]pyridin-2-yl)oxolan-3-ol (CID 22112793) is 3-(7-methoxyfuro[2,3-c]pyridin-2-yl)oxolan-3-ol.
What is the SMILES notation for 3-(7-methoxyfuro[2,3-c]pyridin-2-yl)oxolan-3-ol?
The canonical SMILES for 3-(7-methoxyfuro[2,3-c]pyridin-2-yl)oxolan-3-ol is COc1nccc2cc(C3(O)CCOC3)oc12.
What is the InChIKey of 3-(7-methoxyfuro[2,3-c]pyridin-2-yl)oxolan-3-ol?
The InChIKey is KULMYOIAOYZBKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO4/c1-15-11-10-8(2-4-13-11)6-9(17-10)12(14)3-5-16-7-12/h2,4,6,14H,3,5,7H2,1H3.
What are the key properties of 3-(7-methoxyfuro[2,3-c]pyridin-2-yl)oxolan-3-ol?
3-(7-methoxyfuro[2,3-c]pyridin-2-yl)oxolan-3-ol has a molecular weight of 235.24 g/mol, XLogP of 1.44, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-methoxyfuro[2,3-c]pyridin-2-yl)oxolan-3-ol is sourced from PubChem (CID 22112793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).