3-[3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol

C14H19N3O2 — CID 117159557

IUPAC3-[3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
SMILESOCCCc1nc2cccnc2n1C1CCOCC1
InChIInChI=1S/C14H19N3O2/c18-8-2-4-13-16-12-3-1-7-15-14(12)17(13)11-5-9-19-10-6-11/h1,3,7,11,18H,2,4-6,8-10H2
InChIKeyFOLFFDATFMQDJS-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.71
Rot. Bonds4

About 3-[3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol

3-[3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol (PubChem CID 117159557) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 3-[3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol.

Molecular Properties

Compound Name3-[3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
PubChem CID117159557
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name3-[3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
SMILESOCCCc1nc2cccnc2n1C1CCOCC1
InChIInChI=1S/C14H19N3O2/c18-8-2-4-13-16-12-3-1-7-15-14(12)17(13)11-5-9-19-10-6-11/h1,3,7,11,18H,2,4-6,8-10H2
InChIKeyFOLFFDATFMQDJS-UHFFFAOYSA-N
XLogP1.71
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(oxan-4-yl)-2-(piperidin-4-ylmethyl)imidazo[4,5-b]pyridine
CID 117161522
3-[3-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
CID 117159614
2-tert-butyl-3-(oxan-4-yl)imidazo[4,5-b]pyridine
CID 117166329
3-[2-(oxan-4-ylmethyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol
CID 117161472
3-[3-(oxolan-2-ylmethyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
CID 117159634
3-cyclopropyl-2-(oxan-4-yl)imidazo[4,5-b]pyridine
CID 117160990
3-cyclobutyl-2-(oxolan-3-ylmethyl)imidazo[4,5-b]pyridine
CID 117161425
3-[3-(1-propan-2-ylpiperidin-2-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
CID 117159631
2-(3-cycloheptylimidazo[4,5-b]pyridin-2-yl)ethanamine
CID 82483690
2-(2-chloroethyl)-3-(oxan-3-yl)imidazo[4,5-b]pyridine
CID 79294540
3-(oxolan-3-yl)-2-(thian-4-ylmethyl)imidazo[4,5-b]pyridine
CID 117161501
2-(2-methoxyethyl)-3-(oxan-3-yl)imidazo[4,5-b]pyridine
CID 117159846

Frequently Asked Questions

What is the IUPAC name of 3-[3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol?
The IUPAC name of 3-[3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol (CID 117159557) is 3-[3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol.
What is the SMILES notation for 3-[3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol?
The canonical SMILES for 3-[3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol is OCCCc1nc2cccnc2n1C1CCOCC1.
What is the InChIKey of 3-[3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol?
The InChIKey is FOLFFDATFMQDJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c18-8-2-4-13-16-12-3-1-7-15-14(12)17(13)11-5-9-19-10-6-11/h1,3,7,11,18H,2,4-6,8-10H2.
What are the key properties of 3-[3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol?
3-[3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol has a molecular weight of 261.32 g/mol, XLogP of 1.71, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol is sourced from PubChem (CID 117159557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).