2-ethoxy-4-[3-(oxolan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol

C20H23N3O3 — CID 646357

IUPAC2-ethoxy-4-[3-(oxolan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol
SMILESCCOc1cc(-c2nc3ccccn3c2NCC2CCCO2)ccc1O
InChIInChI=1S/C20H23N3O3/c1-2-25-17-12-14(8-9-16(17)24)19-20(21-13-15-6-5-11-26-15)23-10-4-3-7-18(23)22-19/h3-4,7-10,12,15,21,24H,2,5-6,11,13H2,1H3
InChIKeyZSHGMEGYMWGPKO-UHFFFAOYSA-N
MW353.42 g/mol
LogP3.70
Rot. Bonds6

About 2-ethoxy-4-[3-(oxolan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol

2-ethoxy-4-[3-(oxolan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol (PubChem CID 646357) has the molecular formula C20H23N3O3 and a molecular weight of 353.42 g/mol. Its IUPAC name is 2-ethoxy-4-[3-(oxolan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol.

Molecular Properties

Compound Name2-ethoxy-4-[3-(oxolan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol
PubChem CID646357
Molecular FormulaC20H23N3O3
Molecular Weight353.42 g/mol
Exact Mass353.17
IUPAC Name2-ethoxy-4-[3-(oxolan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol
SMILESCCOc1cc(-c2nc3ccccn3c2NCC2CCCO2)ccc1O
InChIInChI=1S/C20H23N3O3/c1-2-25-17-12-14(8-9-16(17)24)19-20(21-13-15-6-5-11-26-15)23-10-4-3-7-18(23)22-19/h3-4,7-10,12,15,21,24H,2,5-6,11,13H2,1H3
InChIKeyZSHGMEGYMWGPKO-UHFFFAOYSA-N
XLogP3.70
TPSA68.02 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-4-[3-(oxolan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol?
The IUPAC name of 2-ethoxy-4-[3-(oxolan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol (CID 646357) is 2-ethoxy-4-[3-(oxolan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol.
What is the SMILES notation for 2-ethoxy-4-[3-(oxolan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol?
The canonical SMILES for 2-ethoxy-4-[3-(oxolan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol is CCOc1cc(-c2nc3ccccn3c2NCC2CCCO2)ccc1O.
What is the InChIKey of 2-ethoxy-4-[3-(oxolan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol?
The InChIKey is ZSHGMEGYMWGPKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O3/c1-2-25-17-12-14(8-9-16(17)24)19-20(21-13-15-6-5-11-26-15)23-10-4-3-7-18(23)22-19/h3-4,7-10,12,15,21,24H,2,5-6,11,13H2,1H3.
What are the key properties of 2-ethoxy-4-[3-(oxolan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol?
2-ethoxy-4-[3-(oxolan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol has a molecular weight of 353.42 g/mol, XLogP of 3.70, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-4-[3-(oxolan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol is sourced from PubChem (CID 646357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).