(5-methylfuran-2-yl)-pyridin-3-ylmethanol

C11H11NO2 — CID 649084

IUPAC(5-methylfuran-2-yl)-pyridin-3-ylmethanol
SMILESCc1ccc(C(O)c2cccnc2)o1
InChIInChI=1S/C11H11NO2/c1-8-4-5-10(14-8)11(13)9-3-2-6-12-7-9/h2-7,11,13H,1H3
InChIKeyIAJIUQPRKJRSLJ-UHFFFAOYSA-N
MW189.21 g/mol
LogP2.06
Rot. Bonds2

About (5-methylfuran-2-yl)-pyridin-3-ylmethanol

(5-methylfuran-2-yl)-pyridin-3-ylmethanol (PubChem CID 649084) has the molecular formula C11H11NO2 and a molecular weight of 189.21 g/mol. Its IUPAC name is (5-methylfuran-2-yl)-pyridin-3-ylmethanol.

Molecular Properties

Compound Name(5-methylfuran-2-yl)-pyridin-3-ylmethanol
PubChem CID649084
Molecular FormulaC11H11NO2
Molecular Weight189.21 g/mol
Exact Mass189.08
IUPAC Name(5-methylfuran-2-yl)-pyridin-3-ylmethanol
SMILESCc1ccc(C(O)c2cccnc2)o1
InChIInChI=1S/C11H11NO2/c1-8-4-5-10(14-8)11(13)9-3-2-6-12-7-9/h2-7,11,13H,1H3
InChIKeyIAJIUQPRKJRSLJ-UHFFFAOYSA-N
XLogP2.06
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5-methylfuran-2-yl)-pyridin-3-ylmethanol?
The IUPAC name of (5-methylfuran-2-yl)-pyridin-3-ylmethanol (CID 649084) is (5-methylfuran-2-yl)-pyridin-3-ylmethanol.
What is the SMILES notation for (5-methylfuran-2-yl)-pyridin-3-ylmethanol?
The canonical SMILES for (5-methylfuran-2-yl)-pyridin-3-ylmethanol is Cc1ccc(C(O)c2cccnc2)o1.
What is the InChIKey of (5-methylfuran-2-yl)-pyridin-3-ylmethanol?
The InChIKey is IAJIUQPRKJRSLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2/c1-8-4-5-10(14-8)11(13)9-3-2-6-12-7-9/h2-7,11,13H,1H3.
What are the key properties of (5-methylfuran-2-yl)-pyridin-3-ylmethanol?
(5-methylfuran-2-yl)-pyridin-3-ylmethanol has a molecular weight of 189.21 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methylfuran-2-yl)-pyridin-3-ylmethanol is sourced from PubChem (CID 649084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).