4-chloro-3-phenylfuro[2,3-b]pyridine

C13H8ClNO — CID 123943616

IUPAC4-chloro-3-phenylfuro[2,3-b]pyridine
SMILESClc1ccnc2occ(-c3ccccc3)c12
InChIInChI=1S/C13H8ClNO/c14-11-6-7-15-13-12(11)10(8-16-13)9-4-2-1-3-5-9/h1-8H
InChIKeyTWEMMRAGGKKJGD-UHFFFAOYSA-N
MW229.67 g/mol
LogP4.15
Rot. Bonds1

About 4-chloro-3-phenylfuro[2,3-b]pyridine

4-chloro-3-phenylfuro[2,3-b]pyridine (PubChem CID 123943616) has the molecular formula C13H8ClNO and a molecular weight of 229.67 g/mol. Its IUPAC name is 4-chloro-3-phenylfuro[2,3-b]pyridine.

Molecular Properties

Compound Name4-chloro-3-phenylfuro[2,3-b]pyridine
PubChem CID123943616
Molecular FormulaC13H8ClNO
Molecular Weight229.67 g/mol
Exact Mass229.03
IUPAC Name4-chloro-3-phenylfuro[2,3-b]pyridine
SMILESClc1ccnc2occ(-c3ccccc3)c12
InChIInChI=1S/C13H8ClNO/c14-11-6-7-15-13-12(11)10(8-16-13)9-4-2-1-3-5-9/h1-8H
InChIKeyTWEMMRAGGKKJGD-UHFFFAOYSA-N
XLogP4.15
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.67
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-phenylfuro[2,3-b]pyridine?
The IUPAC name of 4-chloro-3-phenylfuro[2,3-b]pyridine (CID 123943616) is 4-chloro-3-phenylfuro[2,3-b]pyridine.
What is the SMILES notation for 4-chloro-3-phenylfuro[2,3-b]pyridine?
The canonical SMILES for 4-chloro-3-phenylfuro[2,3-b]pyridine is Clc1ccnc2occ(-c3ccccc3)c12.
What is the InChIKey of 4-chloro-3-phenylfuro[2,3-b]pyridine?
The InChIKey is TWEMMRAGGKKJGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8ClNO/c14-11-6-7-15-13-12(11)10(8-16-13)9-4-2-1-3-5-9/h1-8H.
What are the key properties of 4-chloro-3-phenylfuro[2,3-b]pyridine?
4-chloro-3-phenylfuro[2,3-b]pyridine has a molecular weight of 229.67 g/mol, XLogP of 4.15, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-phenylfuro[2,3-b]pyridine is sourced from PubChem (CID 123943616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).