6-propan-2-ylfuro[3,2-c]pyridine-7-carbonitrile

C11H10N2O — CID 59589027

IUPAC6-propan-2-ylfuro[3,2-c]pyridine-7-carbonitrile
SMILESCC(C)c1ncc2ccoc2c1C#N
InChIInChI=1S/C11H10N2O/c1-7(2)10-9(5-12)11-8(6-13-10)3-4-14-11/h3-4,6-7H,1-2H3
InChIKeyAKHDQYPKTIZEJQ-UHFFFAOYSA-N
MW186.21 g/mol
LogP2.82
Rot. Bonds1

About 6-propan-2-ylfuro[3,2-c]pyridine-7-carbonitrile

6-propan-2-ylfuro[3,2-c]pyridine-7-carbonitrile (PubChem CID 59589027) has the molecular formula C11H10N2O and a molecular weight of 186.21 g/mol. Its IUPAC name is 6-propan-2-ylfuro[3,2-c]pyridine-7-carbonitrile.

Molecular Properties

Compound Name6-propan-2-ylfuro[3,2-c]pyridine-7-carbonitrile
PubChem CID59589027
Molecular FormulaC11H10N2O
Molecular Weight186.21 g/mol
Exact Mass186.08
IUPAC Name6-propan-2-ylfuro[3,2-c]pyridine-7-carbonitrile
SMILESCC(C)c1ncc2ccoc2c1C#N
InChIInChI=1S/C11H10N2O/c1-7(2)10-9(5-12)11-8(6-13-10)3-4-14-11/h3-4,6-7H,1-2H3
InChIKeyAKHDQYPKTIZEJQ-UHFFFAOYSA-N
XLogP2.82
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 ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-propan-2-ylfuro[3,2-c]pyridine-7-carbonitrile?
The IUPAC name of 6-propan-2-ylfuro[3,2-c]pyridine-7-carbonitrile (CID 59589027) is 6-propan-2-ylfuro[3,2-c]pyridine-7-carbonitrile.
What is the SMILES notation for 6-propan-2-ylfuro[3,2-c]pyridine-7-carbonitrile?
The canonical SMILES for 6-propan-2-ylfuro[3,2-c]pyridine-7-carbonitrile is CC(C)c1ncc2ccoc2c1C#N.
What is the InChIKey of 6-propan-2-ylfuro[3,2-c]pyridine-7-carbonitrile?
The InChIKey is AKHDQYPKTIZEJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O/c1-7(2)10-9(5-12)11-8(6-13-10)3-4-14-11/h3-4,6-7H,1-2H3.
What are the key properties of 6-propan-2-ylfuro[3,2-c]pyridine-7-carbonitrile?
6-propan-2-ylfuro[3,2-c]pyridine-7-carbonitrile has a molecular weight of 186.21 g/mol, XLogP of 2.82, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-ylfuro[3,2-c]pyridine-7-carbonitrile is sourced from PubChem (CID 59589027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).