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

C14H17N3O — CID 117160990

IUPAC3-cyclopropyl-2-(oxan-4-yl)imidazo[4,5-b]pyridine
SMILESc1cnc2c(c1)nc(C1CCOCC1)n2C1CC1
InChIInChI=1S/C14H17N3O/c1-2-12-14(15-7-1)17(11-3-4-11)13(16-12)10-5-8-18-9-6-10/h1-2,7,10-11H,3-6,8-9H2
InChIKeyMPWDBSUXWWHMFD-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.66
Rot. Bonds2

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

3-cyclopropyl-2-(oxan-4-yl)imidazo[4,5-b]pyridine (PubChem CID 117160990) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is 3-cyclopropyl-2-(oxan-4-yl)imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name3-cyclopropyl-2-(oxan-4-yl)imidazo[4,5-b]pyridine
PubChem CID117160990
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC Name3-cyclopropyl-2-(oxan-4-yl)imidazo[4,5-b]pyridine
SMILESc1cnc2c(c1)nc(C1CCOCC1)n2C1CC1
InChIInChI=1S/C14H17N3O/c1-2-12-14(15-7-1)17(11-3-4-11)13(16-12)10-5-8-18-9-6-10/h1-2,7,10-11H,3-6,8-9H2
InChIKeyMPWDBSUXWWHMFD-UHFFFAOYSA-N
XLogP2.66
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-cyclopropyl-2-(oxolan-3-yl)imidazo[4,5-b]pyridine
CID 117160562
3-(1-methylpiperidin-3-yl)-2-(oxan-4-yl)imidazo[4,5-b]pyridine
CID 117160734
2-(oxan-4-yl)-3-(thiolan-2-yl)imidazo[4,5-b]pyridine
CID 117160752
3-tert-butyl-2-(oxan-4-yl)imidazo[4,5-b]pyridine
CID 117160933
2-(oxan-4-yl)-3-pyridin-4-ylimidazo[4,5-b]pyridine
CID 117161034
2-tert-butyl-3-(oxan-4-yl)imidazo[4,5-b]pyridine
CID 117166329
3-(1-methylpiperidin-4-yl)-2-(oxan-3-yl)imidazo[4,5-b]pyridine
CID 117161793
2-(oxan-4-yl)-3-(piperidin-4-ylmethyl)imidazo[4,5-b]pyridine
CID 117160721
3-cyclopropyl-2-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridine
CID 117162666
3-(oxolan-3-yl)-2-pyrrolidin-2-ylimidazo[4,5-b]pyridine
CID 117162190
3-[3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
CID 117159557
2-(5-chlorofuran-2-yl)-3-(oxan-4-yl)imidazo[4,5-b]pyridine
CID 117164183

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-2-(oxan-4-yl)imidazo[4,5-b]pyridine?
The IUPAC name of 3-cyclopropyl-2-(oxan-4-yl)imidazo[4,5-b]pyridine (CID 117160990) is 3-cyclopropyl-2-(oxan-4-yl)imidazo[4,5-b]pyridine.
What is the SMILES notation for 3-cyclopropyl-2-(oxan-4-yl)imidazo[4,5-b]pyridine?
The canonical SMILES for 3-cyclopropyl-2-(oxan-4-yl)imidazo[4,5-b]pyridine is c1cnc2c(c1)nc(C1CCOCC1)n2C1CC1.
What is the InChIKey of 3-cyclopropyl-2-(oxan-4-yl)imidazo[4,5-b]pyridine?
The InChIKey is MPWDBSUXWWHMFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-2-12-14(15-7-1)17(11-3-4-11)13(16-12)10-5-8-18-9-6-10/h1-2,7,10-11H,3-6,8-9H2.
What are the key properties of 3-cyclopropyl-2-(oxan-4-yl)imidazo[4,5-b]pyridine?
3-cyclopropyl-2-(oxan-4-yl)imidazo[4,5-b]pyridine has a molecular weight of 243.31 g/mol, XLogP of 2.66, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-2-(oxan-4-yl)imidazo[4,5-b]pyridine is sourced from PubChem (CID 117160990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).