5-tert-butyl-2-(2-methoxyphenyl)-1H-imidazo[1,2-b][1,2,4]triazole

C15H18N4O — CID 146482462

IUPAC5-tert-butyl-2-(2-methoxyphenyl)-1H-imidazo[1,2-b][1,2,4]triazole
SMILESCOc1ccccc1-c1nc2nc(C(C)(C)C)cn2[nH]1
InChIInChI=1S/C15H18N4O/c1-15(2,3)12-9-19-14(16-12)17-13(18-19)10-7-5-6-8-11(10)20-4/h5-9H,1-4H3,(H,16,17,18)
InChIKeyQXLCOCXGGVPSFU-UHFFFAOYSA-N
MW270.34 g/mol
LogP3.03
Rot. Bonds2

About 5-tert-butyl-2-(2-methoxyphenyl)-1H-imidazo[1,2-b][1,2,4]triazole

5-tert-butyl-2-(2-methoxyphenyl)-1H-imidazo[1,2-b][1,2,4]triazole (PubChem CID 146482462) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 5-tert-butyl-2-(2-methoxyphenyl)-1H-imidazo[1,2-b][1,2,4]triazole.

Molecular Properties

Compound Name5-tert-butyl-2-(2-methoxyphenyl)-1H-imidazo[1,2-b][1,2,4]triazole
PubChem CID146482462
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name5-tert-butyl-2-(2-methoxyphenyl)-1H-imidazo[1,2-b][1,2,4]triazole
SMILESCOc1ccccc1-c1nc2nc(C(C)(C)C)cn2[nH]1
InChIInChI=1S/C15H18N4O/c1-15(2,3)12-9-19-14(16-12)17-13(18-19)10-7-5-6-8-11(10)20-4/h5-9H,1-4H3,(H,16,17,18)
InChIKeyQXLCOCXGGVPSFU-UHFFFAOYSA-N
XLogP3.03
TPSA55.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-tert-butyl-3-(2-methoxyphenyl)-1H-imidazo[2,1-c][1,2,4]triazole
CID 146482460
3-tert-butyl-5-(2-methoxyphenyl)-1,2-oxazole
CID 129255453
6-tert-butyl-2-(2-methoxyphenyl)-N-methylpyrimidin-4-amine
CID 62192683
2-chloro-8-(2-methoxyphenyl)-7H-purine
CID 24904038
2-(2-methoxyphenyl)-1H-imidazole-4,5-dicarboxylic acid
CID 121001392
2,3-difluoro-1,4-bis(2-methoxyphenyl)benzene
CID 58004087
4-ethyl-3-(2-methoxyphenyl)-1H-1,2,4-triazole-5-thione
CID 748123
5-(2,3-dimethoxyphenyl)-2-methyl-1H-1,2,4-triazole-3-thione
CID 104602097
methyl 2-(2-methoxyphenyl)-5-methyl-1H-imidazole-4-carboxylate
CID 43445134
2-(2-methoxyphenyl)-3-[2-(2-methoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]-6-methylimidazo[1,2-a]pyridine
CID 132572546
2-tert-butyl-5-(2-methoxyphenyl)-1,3-oxazole
CID 154771329
1-methoxy-2-[4-[4-(2-methoxyphenyl)phenyl]phenyl]benzene
CID 86116478

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-2-(2-methoxyphenyl)-1H-imidazo[1,2-b][1,2,4]triazole?
The IUPAC name of 5-tert-butyl-2-(2-methoxyphenyl)-1H-imidazo[1,2-b][1,2,4]triazole (CID 146482462) is 5-tert-butyl-2-(2-methoxyphenyl)-1H-imidazo[1,2-b][1,2,4]triazole.
What is the SMILES notation for 5-tert-butyl-2-(2-methoxyphenyl)-1H-imidazo[1,2-b][1,2,4]triazole?
The canonical SMILES for 5-tert-butyl-2-(2-methoxyphenyl)-1H-imidazo[1,2-b][1,2,4]triazole is COc1ccccc1-c1nc2nc(C(C)(C)C)cn2[nH]1.
What is the InChIKey of 5-tert-butyl-2-(2-methoxyphenyl)-1H-imidazo[1,2-b][1,2,4]triazole?
The InChIKey is QXLCOCXGGVPSFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-15(2,3)12-9-19-14(16-12)17-13(18-19)10-7-5-6-8-11(10)20-4/h5-9H,1-4H3,(H,16,17,18).
What are the key properties of 5-tert-butyl-2-(2-methoxyphenyl)-1H-imidazo[1,2-b][1,2,4]triazole?
5-tert-butyl-2-(2-methoxyphenyl)-1H-imidazo[1,2-b][1,2,4]triazole has a molecular weight of 270.34 g/mol, XLogP of 3.03, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-2-(2-methoxyphenyl)-1H-imidazo[1,2-b][1,2,4]triazole is sourced from PubChem (CID 146482462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).