5-(3-bromo-4-methylphenyl)-3-(2-methylpropyl)-2-propylimidazol-4-amine

C17H24BrN3 — CID 105410310

IUPAC5-(3-bromo-4-methylphenyl)-3-(2-methylpropyl)-2-propylimidazol-4-amine
SMILESCCCc1nc(-c2ccc(C)c(Br)c2)c(N)n1CC(C)C
InChIInChI=1S/C17H24BrN3/c1-5-6-15-20-16(17(19)21(15)10-11(2)3)13-8-7-12(4)14(18)9-13/h7-9,11H,5-6,10,19H2,1-4H3
InChIKeyYMWQXGFONSZWCD-UHFFFAOYSA-N
MW350.30 g/mol
LogP4.81
Rot. Bonds5

About 5-(3-bromo-4-methylphenyl)-3-(2-methylpropyl)-2-propylimidazol-4-amine

5-(3-bromo-4-methylphenyl)-3-(2-methylpropyl)-2-propylimidazol-4-amine (PubChem CID 105410310) has the molecular formula C17H24BrN3 and a molecular weight of 350.30 g/mol. Its IUPAC name is 5-(3-bromo-4-methylphenyl)-3-(2-methylpropyl)-2-propylimidazol-4-amine.

Molecular Properties

Compound Name5-(3-bromo-4-methylphenyl)-3-(2-methylpropyl)-2-propylimidazol-4-amine
PubChem CID105410310
Molecular FormulaC17H24BrN3
Molecular Weight350.30 g/mol
Exact Mass349.12
IUPAC Name5-(3-bromo-4-methylphenyl)-3-(2-methylpropyl)-2-propylimidazol-4-amine
SMILESCCCc1nc(-c2ccc(C)c(Br)c2)c(N)n1CC(C)C
InChIInChI=1S/C17H24BrN3/c1-5-6-15-20-16(17(19)21(15)10-11(2)3)13-8-7-12(4)14(18)9-13/h7-9,11H,5-6,10,19H2,1-4H3
InChIKeyYMWQXGFONSZWCD-UHFFFAOYSA-N
XLogP4.81
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.30
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-bromo-3-methylphenyl)-2,3-dipropylimidazol-4-amine
CID 66479273
5-(4-bromophenyl)-2-ethyl-3-(2-methylpropyl)imidazol-4-amine
CID 62219206
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-(5-chloro-2-fluorophenyl)-3-(2-methylpropyl)-2-propylimidazol-4-amine
CID 114859722
5-(2,4-difluorophenyl)-3-(2-methylpropyl)-2-propylimidazol-4-amine
CID 62218894
5-(3-fluoro-4-methylphenyl)-2-methyl-3-(2-methylpropyl)imidazol-4-amine
CID 63647032
5-(4-bromo-3-fluorophenyl)-2-propyl-3-prop-2-ynylimidazol-4-amine
CID 81441852
5-(3-fluoro-4-methylphenyl)-3-prop-2-enyl-2-propylimidazol-4-amine
CID 63645020
5-(3-bromo-4-methylphenyl)-2-tert-butyl-3-propan-2-ylimidazol-4-amine
CID 105410336
5-(3-bromophenyl)-3-prop-2-enyl-2-propylimidazol-4-amine
CID 62218720
5-(4-bromo-3-methylphenyl)-3-butyl-2-propan-2-ylimidazol-4-amine
CID 66480273

Frequently Asked Questions

What is the IUPAC name of 5-(3-bromo-4-methylphenyl)-3-(2-methylpropyl)-2-propylimidazol-4-amine?
The IUPAC name of 5-(3-bromo-4-methylphenyl)-3-(2-methylpropyl)-2-propylimidazol-4-amine (CID 105410310) is 5-(3-bromo-4-methylphenyl)-3-(2-methylpropyl)-2-propylimidazol-4-amine.
What is the SMILES notation for 5-(3-bromo-4-methylphenyl)-3-(2-methylpropyl)-2-propylimidazol-4-amine?
The canonical SMILES for 5-(3-bromo-4-methylphenyl)-3-(2-methylpropyl)-2-propylimidazol-4-amine is CCCc1nc(-c2ccc(C)c(Br)c2)c(N)n1CC(C)C.
What is the InChIKey of 5-(3-bromo-4-methylphenyl)-3-(2-methylpropyl)-2-propylimidazol-4-amine?
The InChIKey is YMWQXGFONSZWCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24BrN3/c1-5-6-15-20-16(17(19)21(15)10-11(2)3)13-8-7-12(4)14(18)9-13/h7-9,11H,5-6,10,19H2,1-4H3.
What are the key properties of 5-(3-bromo-4-methylphenyl)-3-(2-methylpropyl)-2-propylimidazol-4-amine?
5-(3-bromo-4-methylphenyl)-3-(2-methylpropyl)-2-propylimidazol-4-amine has a molecular weight of 350.30 g/mol, XLogP of 4.81, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-bromo-4-methylphenyl)-3-(2-methylpropyl)-2-propylimidazol-4-amine is sourced from PubChem (CID 105410310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).