1-(4-bromophenyl)-N-cyclopentyl-4-methylimidazol-2-amine

C15H18BrN3 — CID 106558608

IUPAC1-(4-bromophenyl)-N-cyclopentyl-4-methylimidazol-2-amine
SMILESCc1cn(-c2ccc(Br)cc2)c(NC2CCCC2)n1
InChIInChI=1S/C15H18BrN3/c1-11-10-19(14-8-6-12(16)7-9-14)15(17-11)18-13-4-2-3-5-13/h6-10,13H,2-5H2,1H3,(H,17,18)
InChIKeyNJKPJAKXSNNMAK-UHFFFAOYSA-N
MW320.23 g/mol
LogP4.30
Rot. Bonds3

About 1-(4-bromophenyl)-N-cyclopentyl-4-methylimidazol-2-amine

1-(4-bromophenyl)-N-cyclopentyl-4-methylimidazol-2-amine (PubChem CID 106558608) has the molecular formula C15H18BrN3 and a molecular weight of 320.23 g/mol. Its IUPAC name is 1-(4-bromophenyl)-N-cyclopentyl-4-methylimidazol-2-amine.

Molecular Properties

Compound Name1-(4-bromophenyl)-N-cyclopentyl-4-methylimidazol-2-amine
PubChem CID106558608
Molecular FormulaC15H18BrN3
Molecular Weight320.23 g/mol
Exact Mass319.07
IUPAC Name1-(4-bromophenyl)-N-cyclopentyl-4-methylimidazol-2-amine
SMILESCc1cn(-c2ccc(Br)cc2)c(NC2CCCC2)n1
InChIInChI=1S/C15H18BrN3/c1-11-10-19(14-8-6-12(16)7-9-14)15(17-11)18-13-4-2-3-5-13/h6-10,13H,2-5H2,1H3,(H,17,18)
InChIKeyNJKPJAKXSNNMAK-UHFFFAOYSA-N
XLogP4.30
TPSA29.85 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 ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-bromophenyl)-N-cyclohexyl-4-methylimidazol-2-amine
CID 106558666
N-cyclopropyl-1-(4-ethoxyphenyl)-4-methylimidazol-2-amine
CID 106555778
N-cyclohexyl-4-methyl-1-(1-methylpyrazol-4-yl)imidazol-2-amine
CID 106562135
N-cyclopropyl-4-methyl-1-(4-propylphenyl)imidazol-2-amine
CID 106561564
N-cyclohexyl-1-(3-iodophenyl)-4-methylimidazol-2-amine
CID 106554243
1-(3-chlorophenyl)-N-cyclohexyl-4-methylimidazol-2-amine
CID 106558404
N-cyclopentyl-1-(3,5-dichloro-4-fluorophenyl)-4-methylimidazol-2-amine
CID 107581397
N-cyclopentyl-1-(3-ethoxyphenyl)-4-methylimidazol-2-amine
CID 106566756
1-[3-bromo-5-(trifluoromethyl)phenyl]-N-cyclopropyl-4-methylimidazol-2-amine
CID 106574055
1-(2-chloro-4-methylphenyl)-N-cyclopentyl-4-methylimidazol-2-amine
CID 106560891
N-cyclopentyl-1-(2-iodophenyl)-4-methylimidazol-2-amine
CID 106554290
1-(5-bromo-2,4-difluorophenyl)-N-cyclopentyl-4-methylimidazol-2-amine
CID 106583046

Frequently Asked Questions

What is the IUPAC name of 1-(4-bromophenyl)-N-cyclopentyl-4-methylimidazol-2-amine?
The IUPAC name of 1-(4-bromophenyl)-N-cyclopentyl-4-methylimidazol-2-amine (CID 106558608) is 1-(4-bromophenyl)-N-cyclopentyl-4-methylimidazol-2-amine.
What is the SMILES notation for 1-(4-bromophenyl)-N-cyclopentyl-4-methylimidazol-2-amine?
The canonical SMILES for 1-(4-bromophenyl)-N-cyclopentyl-4-methylimidazol-2-amine is Cc1cn(-c2ccc(Br)cc2)c(NC2CCCC2)n1.
What is the InChIKey of 1-(4-bromophenyl)-N-cyclopentyl-4-methylimidazol-2-amine?
The InChIKey is NJKPJAKXSNNMAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18BrN3/c1-11-10-19(14-8-6-12(16)7-9-14)15(17-11)18-13-4-2-3-5-13/h6-10,13H,2-5H2,1H3,(H,17,18).
What are the key properties of 1-(4-bromophenyl)-N-cyclopentyl-4-methylimidazol-2-amine?
1-(4-bromophenyl)-N-cyclopentyl-4-methylimidazol-2-amine has a molecular weight of 320.23 g/mol, XLogP of 4.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-bromophenyl)-N-cyclopentyl-4-methylimidazol-2-amine is sourced from PubChem (CID 106558608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).