5-(4-bromophenyl)-2-tert-butyl-3-(2-methylpropyl)imidazol-4-amine

C17H24BrN3 — CID 63467658

IUPAC5-(4-bromophenyl)-2-tert-butyl-3-(2-methylpropyl)imidazol-4-amine
SMILESCC(C)Cn1c(C(C)(C)C)nc(-c2ccc(Br)cc2)c1N
InChIInChI=1S/C17H24BrN3/c1-11(2)10-21-15(19)14(20-16(21)17(3,4)5)12-6-8-13(18)9-7-12/h6-9,11H,10,19H2,1-5H3
InChIKeyIEHYHVZSPDPOEM-UHFFFAOYSA-N
MW350.30 g/mol
LogP4.85
Rot. Bonds3

About 5-(4-bromophenyl)-2-tert-butyl-3-(2-methylpropyl)imidazol-4-amine

5-(4-bromophenyl)-2-tert-butyl-3-(2-methylpropyl)imidazol-4-amine (PubChem CID 63467658) has the molecular formula C17H24BrN3 and a molecular weight of 350.30 g/mol. Its IUPAC name is 5-(4-bromophenyl)-2-tert-butyl-3-(2-methylpropyl)imidazol-4-amine.

Molecular Properties

Compound Name5-(4-bromophenyl)-2-tert-butyl-3-(2-methylpropyl)imidazol-4-amine
PubChem CID63467658
Molecular FormulaC17H24BrN3
Molecular Weight350.30 g/mol
Exact Mass349.12
IUPAC Name5-(4-bromophenyl)-2-tert-butyl-3-(2-methylpropyl)imidazol-4-amine
SMILESCC(C)Cn1c(C(C)(C)C)nc(-c2ccc(Br)cc2)c1N
InChIInChI=1S/C17H24BrN3/c1-11(2)10-21-15(19)14(20-16(21)17(3,4)5)12-6-8-13(18)9-7-12/h6-9,11H,10,19H2,1-5H3
InChIKeyIEHYHVZSPDPOEM-UHFFFAOYSA-N
XLogP4.85
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.30
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-bromophenyl)-2-ethyl-3-(2-methylpropyl)imidazol-4-amine
CID 62219206
2-tert-butyl-3-ethyl-5-(4-fluorophenyl)imidazol-4-amine
CID 62218294
5-(3-bromo-4-chlorophenyl)-2-tert-butyl-3-ethylimidazol-4-amine
CID 83229900
5-(4-bromo-3-fluorophenyl)-2-tert-butyl-3-prop-2-enylimidazol-4-amine
CID 81441356
5-(4-bromo-3-methylphenyl)-2-tert-butyl-3-propylimidazol-4-amine
CID 66481274
5-(4-bromophenyl)-3-butyl-2-propan-2-ylimidazol-4-amine
CID 63469461
2-tert-butyl-5-phenyl-3-prop-2-ynylimidazol-4-amine
CID 62220774
5-(3-bromo-4-chlorophenyl)-2-methyl-3-(2-methylpropyl)imidazol-4-amine
CID 83230987
5-(3-bromophenyl)-2-ethyl-3-(2-methylpropyl)imidazol-4-amine
CID 62219385
5-(3-fluoro-4-methylphenyl)-2-methyl-3-(2-methylpropyl)imidazol-4-amine
CID 63647032
5-(4-tert-butylphenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine
CID 63469094
2-tert-butyl-3-ethyl-5-(3-fluoro-4-methoxyphenyl)imidazol-4-amine
CID 65096311

Frequently Asked Questions

What is the IUPAC name of 5-(4-bromophenyl)-2-tert-butyl-3-(2-methylpropyl)imidazol-4-amine?
The IUPAC name of 5-(4-bromophenyl)-2-tert-butyl-3-(2-methylpropyl)imidazol-4-amine (CID 63467658) is 5-(4-bromophenyl)-2-tert-butyl-3-(2-methylpropyl)imidazol-4-amine.
What is the SMILES notation for 5-(4-bromophenyl)-2-tert-butyl-3-(2-methylpropyl)imidazol-4-amine?
The canonical SMILES for 5-(4-bromophenyl)-2-tert-butyl-3-(2-methylpropyl)imidazol-4-amine is CC(C)Cn1c(C(C)(C)C)nc(-c2ccc(Br)cc2)c1N.
What is the InChIKey of 5-(4-bromophenyl)-2-tert-butyl-3-(2-methylpropyl)imidazol-4-amine?
The InChIKey is IEHYHVZSPDPOEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24BrN3/c1-11(2)10-21-15(19)14(20-16(21)17(3,4)5)12-6-8-13(18)9-7-12/h6-9,11H,10,19H2,1-5H3.
What are the key properties of 5-(4-bromophenyl)-2-tert-butyl-3-(2-methylpropyl)imidazol-4-amine?
5-(4-bromophenyl)-2-tert-butyl-3-(2-methylpropyl)imidazol-4-amine has a molecular weight of 350.30 g/mol, XLogP of 4.85, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-bromophenyl)-2-tert-butyl-3-(2-methylpropyl)imidazol-4-amine is sourced from PubChem (CID 63467658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).