2-ethoxy-4-[8-methyl-3-[[(2S)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]phenol

C21H25N3O3 — CID 1140879

IUPAC2-ethoxy-4-[8-methyl-3-[[(2S)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]phenol
SMILESCCOc1cc(-c2nc3c(C)cccn3c2NC[C@@H]2CCCO2)ccc1O
InChIInChI=1S/C21H25N3O3/c1-3-26-18-12-15(8-9-17(18)25)19-21(22-13-16-7-5-11-27-16)24-10-4-6-14(2)20(24)23-19/h4,6,8-10,12,16,22,25H,3,5,7,11,13H2,1-2H3/t16-/m0/s1
InChIKeyVQSUUBUHENNWAL-INIZCTEOSA-N
MW367.45 g/mol
LogP4.00
Rot. Bonds6

About 2-ethoxy-4-[8-methyl-3-[[(2S)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]phenol

2-ethoxy-4-[8-methyl-3-[[(2S)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]phenol (PubChem CID 1140879) has the molecular formula C21H25N3O3 and a molecular weight of 367.45 g/mol. Its IUPAC name is 2-ethoxy-4-[8-methyl-3-[[(2S)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]phenol.

Molecular Properties

Compound Name2-ethoxy-4-[8-methyl-3-[[(2S)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]phenol
PubChem CID1140879
Molecular FormulaC21H25N3O3
Molecular Weight367.45 g/mol
Exact Mass367.19
IUPAC Name2-ethoxy-4-[8-methyl-3-[[(2S)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]phenol
SMILESCCOc1cc(-c2nc3c(C)cccn3c2NC[C@@H]2CCCO2)ccc1O
InChIInChI=1S/C21H25N3O3/c1-3-26-18-12-15(8-9-17(18)25)19-21(22-13-16-7-5-11-27-16)24-10-4-6-14(2)20(24)23-19/h4,6,8-10,12,16,22,25H,3,5,7,11,13H2,1-2H3/t16-/m0/s1
InChIKeyVQSUUBUHENNWAL-INIZCTEOSA-N
XLogP4.00
TPSA68.02 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-ethoxy-4-[8-methyl-3-[[(2S)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]phenol with MolForge

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Related Compounds

2-ethoxy-4-[3-[[(2R)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyrazin-2-yl]phenol
CID 136691347
4-[8-methyl-3-[[(2R)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]phenol
CID 1154229
2-(2-methoxyphenyl)-8-methyl-N-[[(2R)-oxolan-2-yl]methyl]imidazo[1,2-a]pyridin-3-amine
CID 1140865
3-ethoxy-4-hydroxy-N-[[(2R)-oxolan-2-yl]methyl]benzenecarbothioamide
CID 136822445
N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-[(2R)-oxolan-2-yl]propanamide
CID 94092022
4-N-(2-ethoxyphenyl)-6-N-(oxolan-2-ylmethyl)-2-phenylpyrimidine-4,6-diamine
CID 112880675
2-[3-[[(2S)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyrazin-2-yl]phenol
CID 136681982
2-[4-(4-ethylsulfanylphenyl)-6-(oxolan-2-ylmethylamino)-2-pyridinyl]phenol
CID 137290718
6-ethoxy-2-ethyl-N-(oxolan-2-ylmethyl)pyrimidin-4-amine
CID 82453883
4-[4-(5-ethylthiophen-2-yl)-6-(oxolan-2-ylmethylamino)-2-pyridinyl]-2-methoxyphenol
CID 137290520
2-(1,3-benzodioxol-5-yl)-N-cyclohexyl-8-methylimidazo[1,2-a]pyridin-3-amine
CID 42738420
2-N-(2-ethoxyphenyl)-4-N-(oxolan-2-ylmethyl)pyrimidine-2,4-diamine
CID 112886776

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-4-[8-methyl-3-[[(2S)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]phenol?
The IUPAC name of 2-ethoxy-4-[8-methyl-3-[[(2S)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]phenol (CID 1140879) is 2-ethoxy-4-[8-methyl-3-[[(2S)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]phenol.
What is the SMILES notation for 2-ethoxy-4-[8-methyl-3-[[(2S)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]phenol?
The canonical SMILES for 2-ethoxy-4-[8-methyl-3-[[(2S)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]phenol is CCOc1cc(-c2nc3c(C)cccn3c2NC[C@@H]2CCCO2)ccc1O.
What is the InChIKey of 2-ethoxy-4-[8-methyl-3-[[(2S)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]phenol?
The InChIKey is VQSUUBUHENNWAL-INIZCTEOSA-N. The full InChI is InChI=1S/C21H25N3O3/c1-3-26-18-12-15(8-9-17(18)25)19-21(22-13-16-7-5-11-27-16)24-10-4-6-14(2)20(24)23-19/h4,6,8-10,12,16,22,25H,3,5,7,11,13H2,1-2H3/t16-/m0/s1.
What are the key properties of 2-ethoxy-4-[8-methyl-3-[[(2S)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]phenol?
2-ethoxy-4-[8-methyl-3-[[(2S)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]phenol has a molecular weight of 367.45 g/mol, XLogP of 4.00, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-4-[8-methyl-3-[[(2S)-oxolan-2-yl]methylamino]imidazo[1,2-a]pyridin-2-yl]phenol is sourced from PubChem (CID 1140879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).