3-ethyl-2-(oxolan-2-yl)imidazo[4,5-b]pyridine

C12H15N3O — CID 117162543

IUPAC3-ethyl-2-(oxolan-2-yl)imidazo[4,5-b]pyridine
SMILESCCn1c(C2CCCO2)nc2cccnc21
InChIInChI=1S/C12H15N3O/c1-2-15-11-9(5-3-7-13-11)14-12(15)10-6-4-8-16-10/h3,5,7,10H,2,4,6,8H2,1H3
InChIKeyISYDMTUMRPYPKF-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.30
Rot. Bonds2

About 3-ethyl-2-(oxolan-2-yl)imidazo[4,5-b]pyridine

3-ethyl-2-(oxolan-2-yl)imidazo[4,5-b]pyridine (PubChem CID 117162543) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is 3-ethyl-2-(oxolan-2-yl)imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name3-ethyl-2-(oxolan-2-yl)imidazo[4,5-b]pyridine
PubChem CID117162543
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name3-ethyl-2-(oxolan-2-yl)imidazo[4,5-b]pyridine
SMILESCCn1c(C2CCCO2)nc2cccnc21
InChIInChI=1S/C12H15N3O/c1-2-15-11-9(5-3-7-13-11)14-12(15)10-6-4-8-16-10/h3,5,7,10H,2,4,6,8H2,1H3
InChIKeyISYDMTUMRPYPKF-UHFFFAOYSA-N
XLogP2.30
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-ethyl-2-(oxan-3-yl)imidazo[4,5-b]pyridine
CID 117162008
3-(furan-2-ylmethyl)-2-(oxolan-2-yl)imidazo[4,5-b]pyridine
CID 117162710
3-[(2-methoxyphenyl)methyl]-2-(oxolan-2-yl)imidazo[4,5-b]pyridine
CID 117162517
4-[[2-(oxan-2-yl)imidazo[4,5-b]pyridin-3-yl]methyl]phenol
CID 117162997
3-(1-ethylpyrrolidin-2-yl)-2-(oxan-2-yl)imidazo[4,5-b]pyridine
CID 117162855
2-(oxan-2-yl)-3-(thian-3-ylmethyl)imidazo[4,5-b]pyridine
CID 117162932
3-(1-ethylpiperidin-3-yl)-2-(oxan-2-yl)imidazo[4,5-b]pyridine
CID 117162835
3-(4-chlorophenyl)-2-(oxolan-2-yl)imidazo[4,5-b]pyridine
CID 117162643
3-ethyl-2-(oxan-2-ylmethyl)imidazo[4,5-b]pyridine
CID 117163742
3-(4-methoxyphenyl)-2-(oxan-2-yl)imidazo[4,5-b]pyridine
CID 117163085
3-ethyl-2-methylimidazo[4,5-b]pyridine
CID 23298284
3-[1-(cyclohexylmethyl)piperidin-4-yl]-2-(oxolan-2-yl)imidazo[4,5-b]pyridine
CID 45237210

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-(oxolan-2-yl)imidazo[4,5-b]pyridine?
The IUPAC name of 3-ethyl-2-(oxolan-2-yl)imidazo[4,5-b]pyridine (CID 117162543) is 3-ethyl-2-(oxolan-2-yl)imidazo[4,5-b]pyridine.
What is the SMILES notation for 3-ethyl-2-(oxolan-2-yl)imidazo[4,5-b]pyridine?
The canonical SMILES for 3-ethyl-2-(oxolan-2-yl)imidazo[4,5-b]pyridine is CCn1c(C2CCCO2)nc2cccnc21.
What is the InChIKey of 3-ethyl-2-(oxolan-2-yl)imidazo[4,5-b]pyridine?
The InChIKey is ISYDMTUMRPYPKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-2-15-11-9(5-3-7-13-11)14-12(15)10-6-4-8-16-10/h3,5,7,10H,2,4,6,8H2,1H3.
What are the key properties of 3-ethyl-2-(oxolan-2-yl)imidazo[4,5-b]pyridine?
3-ethyl-2-(oxolan-2-yl)imidazo[4,5-b]pyridine has a molecular weight of 217.27 g/mol, XLogP of 2.30, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-(oxolan-2-yl)imidazo[4,5-b]pyridine is sourced from PubChem (CID 117162543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).