2,5,7-tri(propan-2-yl)furo[3,2-b]pyridine

C16H23NO — CID 134296434

IUPAC2,5,7-tri(propan-2-yl)furo[3,2-b]pyridine
SMILESCC(C)c1cc(C(C)C)c2oc(C(C)C)cc2n1
InChIInChI=1S/C16H23NO/c1-9(2)12-7-13(10(3)4)17-14-8-15(11(5)6)18-16(12)14/h7-11H,1-6H3
InChIKeyQLZFJJWTQAPXHH-UHFFFAOYSA-N
MW245.37 g/mol
LogP5.20
Rot. Bonds3

About 2,5,7-tri(propan-2-yl)furo[3,2-b]pyridine

2,5,7-tri(propan-2-yl)furo[3,2-b]pyridine (PubChem CID 134296434) has the molecular formula C16H23NO and a molecular weight of 245.37 g/mol. Its IUPAC name is 2,5,7-tri(propan-2-yl)furo[3,2-b]pyridine.

Molecular Properties

Compound Name2,5,7-tri(propan-2-yl)furo[3,2-b]pyridine
PubChem CID134296434
Molecular FormulaC16H23NO
Molecular Weight245.37 g/mol
Exact Mass245.18
IUPAC Name2,5,7-tri(propan-2-yl)furo[3,2-b]pyridine
SMILESCC(C)c1cc(C(C)C)c2oc(C(C)C)cc2n1
InChIInChI=1S/C16H23NO/c1-9(2)12-7-13(10(3)4)17-14-8-15(11(5)6)18-16(12)14/h7-11H,1-6H3
InChIKeyQLZFJJWTQAPXHH-UHFFFAOYSA-N
XLogP5.20
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500245.37
LogP ≤ 55.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,5,7-tri(propan-2-yl)furo[3,2-b]pyridine?
The IUPAC name of 2,5,7-tri(propan-2-yl)furo[3,2-b]pyridine (CID 134296434) is 2,5,7-tri(propan-2-yl)furo[3,2-b]pyridine.
What is the SMILES notation for 2,5,7-tri(propan-2-yl)furo[3,2-b]pyridine?
The canonical SMILES for 2,5,7-tri(propan-2-yl)furo[3,2-b]pyridine is CC(C)c1cc(C(C)C)c2oc(C(C)C)cc2n1.
What is the InChIKey of 2,5,7-tri(propan-2-yl)furo[3,2-b]pyridine?
The InChIKey is QLZFJJWTQAPXHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO/c1-9(2)12-7-13(10(3)4)17-14-8-15(11(5)6)18-16(12)14/h7-11H,1-6H3.
What are the key properties of 2,5,7-tri(propan-2-yl)furo[3,2-b]pyridine?
2,5,7-tri(propan-2-yl)furo[3,2-b]pyridine has a molecular weight of 245.37 g/mol, XLogP of 5.20, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5,7-tri(propan-2-yl)furo[3,2-b]pyridine is sourced from PubChem (CID 134296434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).