5-(3-tert-butyl-2-methoxy-5-methylphenyl)-1H-imidazol-2-amine

C15H21N3O — CID 82301222

IUPAC5-(3-tert-butyl-2-methoxy-5-methylphenyl)-1H-imidazol-2-amine
SMILESCOc1c(-c2cnc(N)[nH]2)cc(C)cc1C(C)(C)C
InChIInChI=1S/C15H21N3O/c1-9-6-10(12-8-17-14(16)18-12)13(19-5)11(7-9)15(2,3)4/h6-8H,1-5H3,(H3,16,17,18)
InChIKeyXDFIHZKBALZTFL-UHFFFAOYSA-N
MW259.35 g/mol
LogP3.27
Rot. Bonds2

About 5-(3-tert-butyl-2-methoxy-5-methylphenyl)-1H-imidazol-2-amine

5-(3-tert-butyl-2-methoxy-5-methylphenyl)-1H-imidazol-2-amine (PubChem CID 82301222) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 5-(3-tert-butyl-2-methoxy-5-methylphenyl)-1H-imidazol-2-amine.

Molecular Properties

Compound Name5-(3-tert-butyl-2-methoxy-5-methylphenyl)-1H-imidazol-2-amine
PubChem CID82301222
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name5-(3-tert-butyl-2-methoxy-5-methylphenyl)-1H-imidazol-2-amine
SMILESCOc1c(-c2cnc(N)[nH]2)cc(C)cc1C(C)(C)C
InChIInChI=1S/C15H21N3O/c1-9-6-10(12-8-17-14(16)18-12)13(19-5)11(7-9)15(2,3)4/h6-8H,1-5H3,(H3,16,17,18)
InChIKeyXDFIHZKBALZTFL-UHFFFAOYSA-N
XLogP3.27
TPSA63.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2,5-dimethoxy-3,4-dimethylphenyl)-1H-imidazol-2-amine
CID 116879386
[3-(3-tert-butyl-2-methoxy-5-methylphenyl)-1H-pyrazol-5-yl]methanamine
CID 96669283
5-(3-tert-butyl-2-methoxy-5-methylphenyl)-2H-tetrazole
CID 82295340
5-(7-methoxy-2-methylquinolin-4-yl)-1H-imidazol-2-amine
CID 11543384
2-tert-butyl-6-methoxy-4-methylaniline
CID 175292269
1-[5-(2-methoxy-3,5-dimethylphenyl)-1H-imidazol-2-yl]propan-2-one
CID 116880808
2-(3-tert-butyl-2-methoxyphenyl)-5-methyl-1H-imidazole
CID 126500062
2-(3-tert-butyl-2-methoxy-5-methylphenyl)-2-methylpropan-1-ol
CID 82297608
2-(3-tert-butyl-2-methoxy-5-methylphenyl)-N-methylethanamine
CID 95452310
5-(2,3,5,6-tetramethylphenyl)-1H-imidazol-2-amine
CID 82284738
3-(3-tert-butyl-4-methoxy-5-methylphenyl)-1,2-oxazol-5-amine
CID 117405269
2-bromo-5-(2-methoxy-5-methylphenyl)-1H-imidazole
CID 116884225

Frequently Asked Questions

What is the IUPAC name of 5-(3-tert-butyl-2-methoxy-5-methylphenyl)-1H-imidazol-2-amine?
The IUPAC name of 5-(3-tert-butyl-2-methoxy-5-methylphenyl)-1H-imidazol-2-amine (CID 82301222) is 5-(3-tert-butyl-2-methoxy-5-methylphenyl)-1H-imidazol-2-amine.
What is the SMILES notation for 5-(3-tert-butyl-2-methoxy-5-methylphenyl)-1H-imidazol-2-amine?
The canonical SMILES for 5-(3-tert-butyl-2-methoxy-5-methylphenyl)-1H-imidazol-2-amine is COc1c(-c2cnc(N)[nH]2)cc(C)cc1C(C)(C)C.
What is the InChIKey of 5-(3-tert-butyl-2-methoxy-5-methylphenyl)-1H-imidazol-2-amine?
The InChIKey is XDFIHZKBALZTFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-9-6-10(12-8-17-14(16)18-12)13(19-5)11(7-9)15(2,3)4/h6-8H,1-5H3,(H3,16,17,18).
What are the key properties of 5-(3-tert-butyl-2-methoxy-5-methylphenyl)-1H-imidazol-2-amine?
5-(3-tert-butyl-2-methoxy-5-methylphenyl)-1H-imidazol-2-amine has a molecular weight of 259.35 g/mol, XLogP of 3.27, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-tert-butyl-2-methoxy-5-methylphenyl)-1H-imidazol-2-amine is sourced from PubChem (CID 82301222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).