2-furo[2,3-c]pyridin-2-yl-2-methylpropanenitrile

C11H10N2O — CID 84770056

IUPAC2-furo[2,3-c]pyridin-2-yl-2-methylpropanenitrile
SMILESCC(C)(C#N)c1cc2ccncc2o1
InChIInChI=1S/C11H10N2O/c1-11(2,7-12)10-5-8-3-4-13-6-9(8)14-10/h3-6H,1-2H3
InChIKeyPJYGGYLMGJZTAT-UHFFFAOYSA-N
MW186.21 g/mol
LogP2.63
Rot. Bonds1

About 2-furo[2,3-c]pyridin-2-yl-2-methylpropanenitrile

2-furo[2,3-c]pyridin-2-yl-2-methylpropanenitrile (PubChem CID 84770056) has the molecular formula C11H10N2O and a molecular weight of 186.21 g/mol. Its IUPAC name is 2-furo[2,3-c]pyridin-2-yl-2-methylpropanenitrile.

Molecular Properties

Compound Name2-furo[2,3-c]pyridin-2-yl-2-methylpropanenitrile
PubChem CID84770056
Molecular FormulaC11H10N2O
Molecular Weight186.21 g/mol
Exact Mass186.08
IUPAC Name2-furo[2,3-c]pyridin-2-yl-2-methylpropanenitrile
SMILESCC(C)(C#N)c1cc2ccncc2o1
InChIInChI=1S/C11H10N2O/c1-11(2,7-12)10-5-8-3-4-13-6-9(8)14-10/h3-6H,1-2H3
InChIKeyPJYGGYLMGJZTAT-UHFFFAOYSA-N
XLogP2.63
TPSA49.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-furo[2,3-c]pyridin-2-yl-2-methylpropanenitrile?
The IUPAC name of 2-furo[2,3-c]pyridin-2-yl-2-methylpropanenitrile (CID 84770056) is 2-furo[2,3-c]pyridin-2-yl-2-methylpropanenitrile.
What is the SMILES notation for 2-furo[2,3-c]pyridin-2-yl-2-methylpropanenitrile?
The canonical SMILES for 2-furo[2,3-c]pyridin-2-yl-2-methylpropanenitrile is CC(C)(C#N)c1cc2ccncc2o1.
What is the InChIKey of 2-furo[2,3-c]pyridin-2-yl-2-methylpropanenitrile?
The InChIKey is PJYGGYLMGJZTAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O/c1-11(2,7-12)10-5-8-3-4-13-6-9(8)14-10/h3-6H,1-2H3.
What are the key properties of 2-furo[2,3-c]pyridin-2-yl-2-methylpropanenitrile?
2-furo[2,3-c]pyridin-2-yl-2-methylpropanenitrile has a molecular weight of 186.21 g/mol, XLogP of 2.63, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-furo[2,3-c]pyridin-2-yl-2-methylpropanenitrile is sourced from PubChem (CID 84770056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).