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

C11H15N3O2 — CID 79815532

IUPAC3-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-ol
SMILESCCOc1ccc2[nH]c(CCCO)nc2n1
InChIInChI=1S/C11H15N3O2/c1-2-16-10-6-5-8-11(14-10)13-9(12-8)4-3-7-15/h5-6,15H,2-4,7H2,1H3,(H,12,13,14)
InChIKeyAIMKBKWFEGMECL-UHFFFAOYSA-N
MW221.26 g/mol
LogP1.28
Rot. Bonds5

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

3-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-ol (PubChem CID 79815532) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is 3-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-ol.

Molecular Properties

Compound Name3-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-ol
PubChem CID79815532
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name3-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-ol
SMILESCCOc1ccc2[nH]c(CCCO)nc2n1
InChIInChI=1S/C11H15N3O2/c1-2-16-10-6-5-8-11(14-10)13-9(12-8)4-3-7-15/h5-6,15H,2-4,7H2,1H3,(H,12,13,14)
InChIKeyAIMKBKWFEGMECL-UHFFFAOYSA-N
XLogP1.28
TPSA71.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-ol?
The IUPAC name of 3-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-ol (CID 79815532) is 3-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-ol.
What is the SMILES notation for 3-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-ol?
The canonical SMILES for 3-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-ol is CCOc1ccc2[nH]c(CCCO)nc2n1.
What is the InChIKey of 3-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-ol?
The InChIKey is AIMKBKWFEGMECL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-2-16-10-6-5-8-11(14-10)13-9(12-8)4-3-7-15/h5-6,15H,2-4,7H2,1H3,(H,12,13,14).
What are the key properties of 3-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-ol?
3-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-ol has a molecular weight of 221.26 g/mol, XLogP of 1.28, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-ol is sourced from PubChem (CID 79815532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).