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

C14H19N3O2 — CID 117159846

IUPAC2-(2-methoxyethyl)-3-(oxan-3-yl)imidazo[4,5-b]pyridine
SMILESCOCCc1nc2cccnc2n1C1CCCOC1
InChIInChI=1S/C14H19N3O2/c1-18-9-6-13-16-12-5-2-7-15-14(12)17(13)11-4-3-8-19-10-11/h2,5,7,11H,3-4,6,8-10H2,1H3
InChIKeyOODBGQLRFRMHCW-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.97
Rot. Bonds4

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

2-(2-methoxyethyl)-3-(oxan-3-yl)imidazo[4,5-b]pyridine (PubChem CID 117159846) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 2-(2-methoxyethyl)-3-(oxan-3-yl)imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(2-methoxyethyl)-3-(oxan-3-yl)imidazo[4,5-b]pyridine
PubChem CID117159846
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name2-(2-methoxyethyl)-3-(oxan-3-yl)imidazo[4,5-b]pyridine
SMILESCOCCc1nc2cccnc2n1C1CCCOC1
InChIInChI=1S/C14H19N3O2/c1-18-9-6-13-16-12-5-2-7-15-14(12)17(13)11-4-3-8-19-10-11/h2,5,7,11H,3-4,6,8-10H2,1H3
InChIKeyOODBGQLRFRMHCW-UHFFFAOYSA-N
XLogP1.97
TPSA49.17 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-chloroethyl)-3-(oxan-3-yl)imidazo[4,5-b]pyridine
CID 79294540
2-(2-methoxyethyl)-3-(1-methylpiperidin-3-yl)imidazo[4,5-b]pyridine
CID 117159854
2-tert-butyl-3-(oxan-3-yl)imidazo[4,5-b]pyridine
CID 117166366
3-cyclobutyl-2-(oxolan-3-ylmethyl)imidazo[4,5-b]pyridine
CID 117161425
3-(oxolan-3-yl)-2-(thian-3-ylmethyl)imidazo[4,5-b]pyridine
CID 117163882
2-(3-cycloheptylimidazo[4,5-b]pyridin-2-yl)ethanamine
CID 82483690
3-(oxolan-3-yl)-2-(thian-4-ylmethyl)imidazo[4,5-b]pyridine
CID 117161501
2-(2-chloroethyl)-5-methyl-3-(oxan-3-yl)imidazo[4,5-b]pyridine
CID 81135416
3-ethyl-2-(oxan-3-ylmethyl)imidazo[4,5-b]pyridine
CID 117164016
2-[(2-chlorophenyl)methyl]-3-(oxolan-3-yl)imidazo[4,5-b]pyridine
CID 117165183
2-[(2-fluorophenyl)methyl]-3-(oxolan-3-yl)imidazo[4,5-b]pyridine
CID 117165182
3-[3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
CID 117159557

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethyl)-3-(oxan-3-yl)imidazo[4,5-b]pyridine?
The IUPAC name of 2-(2-methoxyethyl)-3-(oxan-3-yl)imidazo[4,5-b]pyridine (CID 117159846) is 2-(2-methoxyethyl)-3-(oxan-3-yl)imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(2-methoxyethyl)-3-(oxan-3-yl)imidazo[4,5-b]pyridine?
The canonical SMILES for 2-(2-methoxyethyl)-3-(oxan-3-yl)imidazo[4,5-b]pyridine is COCCc1nc2cccnc2n1C1CCCOC1.
What is the InChIKey of 2-(2-methoxyethyl)-3-(oxan-3-yl)imidazo[4,5-b]pyridine?
The InChIKey is OODBGQLRFRMHCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-18-9-6-13-16-12-5-2-7-15-14(12)17(13)11-4-3-8-19-10-11/h2,5,7,11H,3-4,6,8-10H2,1H3.
What are the key properties of 2-(2-methoxyethyl)-3-(oxan-3-yl)imidazo[4,5-b]pyridine?
2-(2-methoxyethyl)-3-(oxan-3-yl)imidazo[4,5-b]pyridine has a molecular weight of 261.32 g/mol, XLogP of 1.97, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethyl)-3-(oxan-3-yl)imidazo[4,5-b]pyridine is sourced from PubChem (CID 117159846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).