3-(5-chlorofuran-2-yl)-2-(oxan-3-yl)imidazo[4,5-b]pyridine

C15H14ClN3O2 — CID 117161953

IUPAC3-(5-chlorofuran-2-yl)-2-(oxan-3-yl)imidazo[4,5-b]pyridine
SMILESClc1ccc(-n2c(C3CCCOC3)nc3cccnc32)o1
InChIInChI=1S/C15H14ClN3O2/c16-12-5-6-13(21-12)19-14(10-3-2-8-20-9-10)18-11-4-1-7-17-15(11)19/h1,4-7,10H,2-3,8-9H2
InChIKeyBNMIJYJYFAEWNA-UHFFFAOYSA-N
MW303.75 g/mol
LogP3.56
Rot. Bonds2

About 3-(5-chlorofuran-2-yl)-2-(oxan-3-yl)imidazo[4,5-b]pyridine

3-(5-chlorofuran-2-yl)-2-(oxan-3-yl)imidazo[4,5-b]pyridine (PubChem CID 117161953) has the molecular formula C15H14ClN3O2 and a molecular weight of 303.75 g/mol. Its IUPAC name is 3-(5-chlorofuran-2-yl)-2-(oxan-3-yl)imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name3-(5-chlorofuran-2-yl)-2-(oxan-3-yl)imidazo[4,5-b]pyridine
PubChem CID117161953
Molecular FormulaC15H14ClN3O2
Molecular Weight303.75 g/mol
Exact Mass303.08
IUPAC Name3-(5-chlorofuran-2-yl)-2-(oxan-3-yl)imidazo[4,5-b]pyridine
SMILESClc1ccc(-n2c(C3CCCOC3)nc3cccnc32)o1
InChIInChI=1S/C15H14ClN3O2/c16-12-5-6-13(21-12)19-14(10-3-2-8-20-9-10)18-11-4-1-7-17-15(11)19/h1,4-7,10H,2-3,8-9H2
InChIKeyBNMIJYJYFAEWNA-UHFFFAOYSA-N
XLogP3.56
TPSA53.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.75
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-ethyl-2-(oxan-3-yl)imidazo[4,5-b]pyridine
CID 117162008
3-(3-chlorophenyl)-2-(oxolan-3-yl)imidazo[4,5-b]pyridine
CID 117160489
3-(1-methylpiperidin-4-yl)-2-(oxan-3-yl)imidazo[4,5-b]pyridine
CID 117161793
2-(oxan-3-yl)-3-(oxan-2-ylmethyl)imidazo[4,5-b]pyridine
CID 117161927
3-[(1-methylpyrrolidin-2-yl)methyl]-2-(oxan-3-yl)imidazo[4,5-b]pyridine
CID 117161911
3-(2-methylphenyl)-2-(oxolan-3-yl)imidazo[4,5-b]pyridine
CID 117160516
3-cyclopropyl-2-(oxolan-3-yl)imidazo[4,5-b]pyridine
CID 117160562
2-(oxan-3-yl)-3-(pyrrolidin-2-ylmethyl)imidazo[4,5-b]pyridine
CID 117161910
3-(5-methylfuran-2-yl)-2-(thian-3-yl)imidazo[4,5-b]pyridine
CID 117161959
3-(5-methylthiophen-2-yl)-2-(oxolan-3-yl)imidazo[4,5-b]pyridine
CID 117160343
3-(5-methylfuran-2-yl)-2-piperidin-4-ylimidazo[4,5-b]pyridine
CID 117160855
3-(1-ethylpyrrolidin-3-yl)-2-(oxan-3-yl)imidazo[4,5-b]pyridine
CID 117161767

Frequently Asked Questions

What is the IUPAC name of 3-(5-chlorofuran-2-yl)-2-(oxan-3-yl)imidazo[4,5-b]pyridine?
The IUPAC name of 3-(5-chlorofuran-2-yl)-2-(oxan-3-yl)imidazo[4,5-b]pyridine (CID 117161953) is 3-(5-chlorofuran-2-yl)-2-(oxan-3-yl)imidazo[4,5-b]pyridine.
What is the SMILES notation for 3-(5-chlorofuran-2-yl)-2-(oxan-3-yl)imidazo[4,5-b]pyridine?
The canonical SMILES for 3-(5-chlorofuran-2-yl)-2-(oxan-3-yl)imidazo[4,5-b]pyridine is Clc1ccc(-n2c(C3CCCOC3)nc3cccnc32)o1.
What is the InChIKey of 3-(5-chlorofuran-2-yl)-2-(oxan-3-yl)imidazo[4,5-b]pyridine?
The InChIKey is BNMIJYJYFAEWNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClN3O2/c16-12-5-6-13(21-12)19-14(10-3-2-8-20-9-10)18-11-4-1-7-17-15(11)19/h1,4-7,10H,2-3,8-9H2.
What are the key properties of 3-(5-chlorofuran-2-yl)-2-(oxan-3-yl)imidazo[4,5-b]pyridine?
3-(5-chlorofuran-2-yl)-2-(oxan-3-yl)imidazo[4,5-b]pyridine has a molecular weight of 303.75 g/mol, XLogP of 3.56, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-chlorofuran-2-yl)-2-(oxan-3-yl)imidazo[4,5-b]pyridine is sourced from PubChem (CID 117161953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).