3-(5-methylfuran-2-yl)-2-(1-methylpiperidin-2-yl)imidazo[4,5-b]pyridine

C17H20N4O — CID 117162958

IUPAC3-(5-methylfuran-2-yl)-2-(1-methylpiperidin-2-yl)imidazo[4,5-b]pyridine
SMILESCc1ccc(-n2c(C3CCCCN3C)nc3cccnc32)o1
InChIInChI=1S/C17H20N4O/c1-12-8-9-15(22-12)21-16-13(6-5-10-18-16)19-17(21)14-7-3-4-11-20(14)2/h5-6,8-10,14H,3-4,7,11H2,1-2H3
InChIKeyRKVYMBRWGYUIAW-UHFFFAOYSA-N
MW296.37 g/mol
LogP3.48
Rot. Bonds2

About 3-(5-methylfuran-2-yl)-2-(1-methylpiperidin-2-yl)imidazo[4,5-b]pyridine

3-(5-methylfuran-2-yl)-2-(1-methylpiperidin-2-yl)imidazo[4,5-b]pyridine (PubChem CID 117162958) has the molecular formula C17H20N4O and a molecular weight of 296.37 g/mol. Its IUPAC name is 3-(5-methylfuran-2-yl)-2-(1-methylpiperidin-2-yl)imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name3-(5-methylfuran-2-yl)-2-(1-methylpiperidin-2-yl)imidazo[4,5-b]pyridine
PubChem CID117162958
Molecular FormulaC17H20N4O
Molecular Weight296.37 g/mol
Exact Mass296.16
IUPAC Name3-(5-methylfuran-2-yl)-2-(1-methylpiperidin-2-yl)imidazo[4,5-b]pyridine
SMILESCc1ccc(-n2c(C3CCCCN3C)nc3cccnc32)o1
InChIInChI=1S/C17H20N4O/c1-12-8-9-15(22-12)21-16-13(6-5-10-18-16)19-17(21)14-7-3-4-11-20(14)2/h5-6,8-10,14H,3-4,7,11H2,1-2H3
InChIKeyRKVYMBRWGYUIAW-UHFFFAOYSA-N
XLogP3.48
TPSA47.09 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1-methylpiperidin-2-yl)-3-pyridin-2-ylimidazo[4,5-b]pyridine
CID 117162978
3-(4-methylphenyl)-2-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridine
CID 117162652
3-(5-methylfuran-2-yl)-2-piperidin-4-ylimidazo[4,5-b]pyridine
CID 117160855
3-cyclopentyl-2-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridine
CID 117162679
2-(1-methylpiperidin-2-yl)-3-(oxolan-2-yl)imidazo[4,5-b]pyridine
CID 117162863
2-[3-(5-methylfuran-2-yl)imidazo[4,5-b]pyridin-2-yl]thiolane 1,1-dioxide
CID 117162452
3-(5-methylfuran-2-yl)-2-(thian-3-yl)imidazo[4,5-b]pyridine
CID 117161959
3-(3-fluorophenyl)-2-(1-methylpiperidin-2-yl)imidazo[4,5-b]pyridine
CID 117163061
3-(2-methoxyethyl)-2-(1-methylpiperidin-2-yl)imidazo[4,5-b]pyridine
CID 117162749
3-(2,2-dimethylpropyl)-2-(1-methylpiperidin-2-yl)imidazo[4,5-b]pyridine
CID 117163017
3-cyclopropyl-2-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridine
CID 117162666
3-(3-chlorophenyl)-2-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridine
CID 117162609

Frequently Asked Questions

What is the IUPAC name of 3-(5-methylfuran-2-yl)-2-(1-methylpiperidin-2-yl)imidazo[4,5-b]pyridine?
The IUPAC name of 3-(5-methylfuran-2-yl)-2-(1-methylpiperidin-2-yl)imidazo[4,5-b]pyridine (CID 117162958) is 3-(5-methylfuran-2-yl)-2-(1-methylpiperidin-2-yl)imidazo[4,5-b]pyridine.
What is the SMILES notation for 3-(5-methylfuran-2-yl)-2-(1-methylpiperidin-2-yl)imidazo[4,5-b]pyridine?
The canonical SMILES for 3-(5-methylfuran-2-yl)-2-(1-methylpiperidin-2-yl)imidazo[4,5-b]pyridine is Cc1ccc(-n2c(C3CCCCN3C)nc3cccnc32)o1.
What is the InChIKey of 3-(5-methylfuran-2-yl)-2-(1-methylpiperidin-2-yl)imidazo[4,5-b]pyridine?
The InChIKey is RKVYMBRWGYUIAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O/c1-12-8-9-15(22-12)21-16-13(6-5-10-18-16)19-17(21)14-7-3-4-11-20(14)2/h5-6,8-10,14H,3-4,7,11H2,1-2H3.
What are the key properties of 3-(5-methylfuran-2-yl)-2-(1-methylpiperidin-2-yl)imidazo[4,5-b]pyridine?
3-(5-methylfuran-2-yl)-2-(1-methylpiperidin-2-yl)imidazo[4,5-b]pyridine has a molecular weight of 296.37 g/mol, XLogP of 3.48, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methylfuran-2-yl)-2-(1-methylpiperidin-2-yl)imidazo[4,5-b]pyridine is sourced from PubChem (CID 117162958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).