2-methoxy-4-[3-[(4-methoxyphenyl)methylamino]imidazo[1,2-a]pyrazin-2-yl]phenol

C21H20N4O3 — CID 135674311

IUPAC2-methoxy-4-[3-[(4-methoxyphenyl)methylamino]imidazo[1,2-a]pyrazin-2-yl]phenol
SMILESCOc1ccc(CNc2c(-c3ccc(O)c(OC)c3)nc3cnccn23)cc1
InChIInChI=1S/C21H20N4O3/c1-27-16-6-3-14(4-7-16)12-23-21-20(24-19-13-22-9-10-25(19)21)15-5-8-17(26)18(11-15)28-2/h3-11,13,23,26H,12H2,1-2H3
InChIKeyMLQZYMZDXWALLG-UHFFFAOYSA-N
MW376.42 g/mol
LogP3.73
Rot. Bonds6

About 2-methoxy-4-[3-[(4-methoxyphenyl)methylamino]imidazo[1,2-a]pyrazin-2-yl]phenol

2-methoxy-4-[3-[(4-methoxyphenyl)methylamino]imidazo[1,2-a]pyrazin-2-yl]phenol (PubChem CID 135674311) has the molecular formula C21H20N4O3 and a molecular weight of 376.42 g/mol. Its IUPAC name is 2-methoxy-4-[3-[(4-methoxyphenyl)methylamino]imidazo[1,2-a]pyrazin-2-yl]phenol.

Molecular Properties

Compound Name2-methoxy-4-[3-[(4-methoxyphenyl)methylamino]imidazo[1,2-a]pyrazin-2-yl]phenol
PubChem CID135674311
Molecular FormulaC21H20N4O3
Molecular Weight376.42 g/mol
Exact Mass376.15
IUPAC Name2-methoxy-4-[3-[(4-methoxyphenyl)methylamino]imidazo[1,2-a]pyrazin-2-yl]phenol
SMILESCOc1ccc(CNc2c(-c3ccc(O)c(OC)c3)nc3cnccn23)cc1
InChIInChI=1S/C21H20N4O3/c1-27-16-6-3-14(4-7-16)12-23-21-20(24-19-13-22-9-10-25(19)21)15-5-8-17(26)18(11-15)28-2/h3-11,13,23,26H,12H2,1-2H3
InChIKeyMLQZYMZDXWALLG-UHFFFAOYSA-N
XLogP3.73
TPSA80.91 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.42
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

7-Methyl-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 146659124
Bay 61-3606
CID 10200390
2-(4-Methoxyphenyl)imidazo[1,2-a]pyridine
CID 694963
2-(4-Propoxyphenyl)imidazo[1,2-a]pyridine
CID 2876085
Imoxiterol
CID 65665
6-(3,4-dimethoxyphenyl)-7-methyl-5H-pyrrolo[2,3-b]pyrazine
CID 6538783
1-(6-{[(3,4-dimethoxyphenyl)methyl]amino}-9-(propan-2-yl)-9H-purin-2-yl)-3-methylpent-1-yn-3-ol
CID 6538963
Cis-3-[8-Amino-1-(4-Phenoxyphenyl)imidazo[1,5-A]pyrazin-3-Yl]cyclobutanol
CID 44539087
4-(Imidazo[1,2-a]pyridin-2-yl)benzene-1,2-diol
CID 764266
3-(4-Propan-2-yloxyphenyl)-6-(6-propan-2-yloxy-3-pyridinyl)imidazo[1,2-a]pyridine
CID 134179257
7-Methyl-3,6-bis(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 134179283
3-(4-Cyclopropyloxyphenyl)-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 134179286

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-[3-[(4-methoxyphenyl)methylamino]imidazo[1,2-a]pyrazin-2-yl]phenol?
The IUPAC name of 2-methoxy-4-[3-[(4-methoxyphenyl)methylamino]imidazo[1,2-a]pyrazin-2-yl]phenol (CID 135674311) is 2-methoxy-4-[3-[(4-methoxyphenyl)methylamino]imidazo[1,2-a]pyrazin-2-yl]phenol.
What is the SMILES notation for 2-methoxy-4-[3-[(4-methoxyphenyl)methylamino]imidazo[1,2-a]pyrazin-2-yl]phenol?
The canonical SMILES for 2-methoxy-4-[3-[(4-methoxyphenyl)methylamino]imidazo[1,2-a]pyrazin-2-yl]phenol is COc1ccc(CNc2c(-c3ccc(O)c(OC)c3)nc3cnccn23)cc1.
What is the InChIKey of 2-methoxy-4-[3-[(4-methoxyphenyl)methylamino]imidazo[1,2-a]pyrazin-2-yl]phenol?
The InChIKey is MLQZYMZDXWALLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O3/c1-27-16-6-3-14(4-7-16)12-23-21-20(24-19-13-22-9-10-25(19)21)15-5-8-17(26)18(11-15)28-2/h3-11,13,23,26H,12H2,1-2H3.
What are the key properties of 2-methoxy-4-[3-[(4-methoxyphenyl)methylamino]imidazo[1,2-a]pyrazin-2-yl]phenol?
2-methoxy-4-[3-[(4-methoxyphenyl)methylamino]imidazo[1,2-a]pyrazin-2-yl]phenol has a molecular weight of 376.42 g/mol, XLogP of 3.73, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-[3-[(4-methoxyphenyl)methylamino]imidazo[1,2-a]pyrazin-2-yl]phenol is sourced from PubChem (CID 135674311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).