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

C15H10ClN3O2 — CID 117164651

IUPAC2-(5-chlorofuran-2-yl)-3-(furan-2-ylmethyl)imidazo[4,5-b]pyridine
SMILESClc1ccc(-c2nc3cccnc3n2Cc2ccco2)o1
InChIInChI=1S/C15H10ClN3O2/c16-13-6-5-12(21-13)15-18-11-4-1-7-17-14(11)19(15)9-10-3-2-8-20-10/h1-8H,9H2
InChIKeyVQNBXQSPBCIUCZ-UHFFFAOYSA-N
MW299.72 g/mol
LogP3.99
Rot. Bonds3

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

2-(5-chlorofuran-2-yl)-3-(furan-2-ylmethyl)imidazo[4,5-b]pyridine (PubChem CID 117164651) has the molecular formula C15H10ClN3O2 and a molecular weight of 299.72 g/mol. Its IUPAC name is 2-(5-chlorofuran-2-yl)-3-(furan-2-ylmethyl)imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(5-chlorofuran-2-yl)-3-(furan-2-ylmethyl)imidazo[4,5-b]pyridine
PubChem CID117164651
Molecular FormulaC15H10ClN3O2
Molecular Weight299.72 g/mol
Exact Mass299.05
IUPAC Name2-(5-chlorofuran-2-yl)-3-(furan-2-ylmethyl)imidazo[4,5-b]pyridine
SMILESClc1ccc(-c2nc3cccnc3n2Cc2ccco2)o1
InChIInChI=1S/C15H10ClN3O2/c16-13-6-5-12(21-13)15-18-11-4-1-7-17-14(11)19(15)9-10-3-2-8-20-10/h1-8H,9H2
InChIKeyVQNBXQSPBCIUCZ-UHFFFAOYSA-N
XLogP3.99
TPSA56.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.72
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(5-chlorofuran-2-yl)-3-(pyrrolidin-2-ylmethyl)imidazo[4,5-b]pyridine
CID 117164355
2-(furan-2-yl)-3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridine
CID 117164482
2-(5-chlorofuran-2-yl)-3-[(1-methylpyrrolidin-2-yl)methyl]imidazo[4,5-b]pyridine
CID 117164356
2-[3-(furan-2-ylmethyl)imidazo[4,5-b]pyridin-2-yl]ethanol
CID 117160032
2-[2-(5-chlorofuran-2-yl)imidazo[4,5-b]pyridin-3-yl]phenol
CID 117164578
3-(furan-2-ylmethyl)-2-(oxolan-2-yl)imidazo[4,5-b]pyridine
CID 117162710
2-(5-chlorofuran-2-yl)-3-(oxan-4-yl)imidazo[4,5-b]pyridine
CID 117164183
3-(furan-2-ylmethyl)-2-(1-methylpiperidin-3-yl)imidazo[4,5-b]pyridine
CID 117162140
3-(furan-2-ylmethyl)-2-(oxolan-2-ylmethyl)imidazo[4,5-b]pyridine
CID 117163565
2-(5-methylfuran-2-yl)-3-[(1-methylpyrrolidin-2-yl)methyl]imidazo[4,5-b]pyridine
CID 117164354
2-(furan-2-yl)-1-(furan-2-ylmethyl)imidazo[4,5-f]quinoxaline
CID 13428681
2-(furan-2-yl)-3-[(1-methylpiperidin-2-yl)methyl]imidazo[4,5-b]pyridine
CID 117164375

Frequently Asked Questions

What is the IUPAC name of 2-(5-chlorofuran-2-yl)-3-(furan-2-ylmethyl)imidazo[4,5-b]pyridine?
The IUPAC name of 2-(5-chlorofuran-2-yl)-3-(furan-2-ylmethyl)imidazo[4,5-b]pyridine (CID 117164651) is 2-(5-chlorofuran-2-yl)-3-(furan-2-ylmethyl)imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(5-chlorofuran-2-yl)-3-(furan-2-ylmethyl)imidazo[4,5-b]pyridine?
The canonical SMILES for 2-(5-chlorofuran-2-yl)-3-(furan-2-ylmethyl)imidazo[4,5-b]pyridine is Clc1ccc(-c2nc3cccnc3n2Cc2ccco2)o1.
What is the InChIKey of 2-(5-chlorofuran-2-yl)-3-(furan-2-ylmethyl)imidazo[4,5-b]pyridine?
The InChIKey is VQNBXQSPBCIUCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClN3O2/c16-13-6-5-12(21-13)15-18-11-4-1-7-17-14(11)19(15)9-10-3-2-8-20-10/h1-8H,9H2.
What are the key properties of 2-(5-chlorofuran-2-yl)-3-(furan-2-ylmethyl)imidazo[4,5-b]pyridine?
2-(5-chlorofuran-2-yl)-3-(furan-2-ylmethyl)imidazo[4,5-b]pyridine has a molecular weight of 299.72 g/mol, XLogP of 3.99, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chlorofuran-2-yl)-3-(furan-2-ylmethyl)imidazo[4,5-b]pyridine is sourced from PubChem (CID 117164651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).