5-(2-bromophenyl)-3-cyclopropyl-2-propan-2-ylimidazol-4-amine

C15H18BrN3 — CID 55048971

IUPAC5-(2-bromophenyl)-3-cyclopropyl-2-propan-2-ylimidazol-4-amine
SMILESCC(C)c1nc(-c2ccccc2Br)c(N)n1C1CC1
InChIInChI=1S/C15H18BrN3/c1-9(2)15-18-13(11-5-3-4-6-12(11)16)14(17)19(15)10-7-8-10/h3-6,9-10H,7-8,17H2,1-2H3
InChIKeyJFIPYUPSVPEMQH-UHFFFAOYSA-N
MW320.23 g/mol
LogP4.35
Rot. Bonds3

About 5-(2-bromophenyl)-3-cyclopropyl-2-propan-2-ylimidazol-4-amine

5-(2-bromophenyl)-3-cyclopropyl-2-propan-2-ylimidazol-4-amine (PubChem CID 55048971) has the molecular formula C15H18BrN3 and a molecular weight of 320.23 g/mol. Its IUPAC name is 5-(2-bromophenyl)-3-cyclopropyl-2-propan-2-ylimidazol-4-amine.

Molecular Properties

Compound Name5-(2-bromophenyl)-3-cyclopropyl-2-propan-2-ylimidazol-4-amine
PubChem CID55048971
Molecular FormulaC15H18BrN3
Molecular Weight320.23 g/mol
Exact Mass319.07
IUPAC Name5-(2-bromophenyl)-3-cyclopropyl-2-propan-2-ylimidazol-4-amine
SMILESCC(C)c1nc(-c2ccccc2Br)c(N)n1C1CC1
InChIInChI=1S/C15H18BrN3/c1-9(2)15-18-13(11-5-3-4-6-12(11)16)14(17)19(15)10-7-8-10/h3-6,9-10H,7-8,17H2,1-2H3
InChIKeyJFIPYUPSVPEMQH-UHFFFAOYSA-N
XLogP4.35
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.23
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyclopropyl-5-(3-methylphenyl)-2-propan-2-ylimidazol-4-amine
CID 62220711
3-cyclopropyl-5-(4-cyclopropylphenyl)-2-propan-2-ylimidazol-4-amine
CID 79971887
5-(3-chlorophenyl)-3-cyclopropyl-2-propan-2-ylimidazol-4-amine
CID 62219271
3-cyclopropyl-5-(2-phenylethyl)-2-propan-2-ylimidazol-4-amine
CID 62880244
3-cyclopropyl-5-(3-cyclopropylimidazol-4-yl)-2-propan-2-ylimidazol-4-amine
CID 66162715
5-(2-bromophenyl)-2-cyclohexyl-3-methylimidazol-4-amine
CID 62222947
4-(2-methylphenyl)-2-propan-2-ylimidazole-1,5-diamine
CID 62506943
5-(2-fluorophenyl)-2,3-di(propan-2-yl)imidazol-4-amine
CID 62219797
3-cyclopropyl-2-methyl-5-phenylimidazol-4-amine
CID 53275781
3-cyclopropyl-2-methyl-5-[2-(trifluoromethoxy)phenyl]imidazol-4-amine
CID 62224490
5-(2-bromo-5-chlorophenyl)-2,3-di(propan-2-yl)imidazol-4-amine
CID 66161306
5-(2,3-dichlorophenyl)-2,3-di(propan-2-yl)imidazol-4-amine
CID 62219798

Frequently Asked Questions

What is the IUPAC name of 5-(2-bromophenyl)-3-cyclopropyl-2-propan-2-ylimidazol-4-amine?
The IUPAC name of 5-(2-bromophenyl)-3-cyclopropyl-2-propan-2-ylimidazol-4-amine (CID 55048971) is 5-(2-bromophenyl)-3-cyclopropyl-2-propan-2-ylimidazol-4-amine.
What is the SMILES notation for 5-(2-bromophenyl)-3-cyclopropyl-2-propan-2-ylimidazol-4-amine?
The canonical SMILES for 5-(2-bromophenyl)-3-cyclopropyl-2-propan-2-ylimidazol-4-amine is CC(C)c1nc(-c2ccccc2Br)c(N)n1C1CC1.
What is the InChIKey of 5-(2-bromophenyl)-3-cyclopropyl-2-propan-2-ylimidazol-4-amine?
The InChIKey is JFIPYUPSVPEMQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18BrN3/c1-9(2)15-18-13(11-5-3-4-6-12(11)16)14(17)19(15)10-7-8-10/h3-6,9-10H,7-8,17H2,1-2H3.
What are the key properties of 5-(2-bromophenyl)-3-cyclopropyl-2-propan-2-ylimidazol-4-amine?
5-(2-bromophenyl)-3-cyclopropyl-2-propan-2-ylimidazol-4-amine has a molecular weight of 320.23 g/mol, XLogP of 4.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-bromophenyl)-3-cyclopropyl-2-propan-2-ylimidazol-4-amine is sourced from PubChem (CID 55048971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).