N-(5-bromo-2-methoxyphenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine

C15H20BrN3O — CID 106569054

IUPACN-(5-bromo-2-methoxyphenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine
SMILESCOc1ccc(Br)cc1Nc1nc(C)cn1CC(C)C
InChIInChI=1S/C15H20BrN3O/c1-10(2)8-19-9-11(3)17-15(19)18-13-7-12(16)5-6-14(13)20-4/h5-7,9-10H,8H2,1-4H3,(H,17,18)
InChIKeyJJNODFLITUZINB-UHFFFAOYSA-N
MW338.25 g/mol
LogP4.36
Rot. Bonds5

About N-(5-bromo-2-methoxyphenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine

N-(5-bromo-2-methoxyphenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine (PubChem CID 106569054) has the molecular formula C15H20BrN3O and a molecular weight of 338.25 g/mol. Its IUPAC name is N-(5-bromo-2-methoxyphenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine.

Molecular Properties

Compound NameN-(5-bromo-2-methoxyphenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine
PubChem CID106569054
Molecular FormulaC15H20BrN3O
Molecular Weight338.25 g/mol
Exact Mass337.08
IUPAC NameN-(5-bromo-2-methoxyphenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine
SMILESCOc1ccc(Br)cc1Nc1nc(C)cn1CC(C)C
InChIInChI=1S/C15H20BrN3O/c1-10(2)8-19-9-11(3)17-15(19)18-13-7-12(16)5-6-14(13)20-4/h5-7,9-10H,8H2,1-4H3,(H,17,18)
InChIKeyJJNODFLITUZINB-UHFFFAOYSA-N
XLogP4.36
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.25
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-bromo-2-methylphenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine
CID 106562857
N-(5-bromo-2-methoxyphenyl)-4-methyl-1-prop-2-enylimidazol-2-amine
CID 106569082
N-(3-bromo-5-methylphenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine
CID 107581439
N-(4-bromo-2,6-difluorophenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine
CID 106574063
1-butyl-N-(2-methoxy-5-methylphenyl)-4-methylimidazol-2-amine
CID 106557792
N-(2-chloro-4-fluorophenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine
CID 106554114
5-methyl-N-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]pyridin-3-amine
CID 107587276
4-N-(5-bromo-2-methoxyphenyl)-6-methylpyrimidine-2,4-diamine
CID 80804517
N-[4-bromo-2-(trifluoromethoxy)phenyl]-1-ethyl-4-methylimidazol-2-amine
CID 106583303
N-(4-bromo-2-chlorophenyl)-1-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106561203
N-(4-fluorophenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine
CID 106558695
N-(2,5-dibromophenyl)-4-methyl-1-propan-2-ylimidazol-2-amine
CID 106566391

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-methoxyphenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine?
The IUPAC name of N-(5-bromo-2-methoxyphenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine (CID 106569054) is N-(5-bromo-2-methoxyphenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine.
What is the SMILES notation for N-(5-bromo-2-methoxyphenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine?
The canonical SMILES for N-(5-bromo-2-methoxyphenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine is COc1ccc(Br)cc1Nc1nc(C)cn1CC(C)C.
What is the InChIKey of N-(5-bromo-2-methoxyphenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine?
The InChIKey is JJNODFLITUZINB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20BrN3O/c1-10(2)8-19-9-11(3)17-15(19)18-13-7-12(16)5-6-14(13)20-4/h5-7,9-10H,8H2,1-4H3,(H,17,18).
What are the key properties of N-(5-bromo-2-methoxyphenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine?
N-(5-bromo-2-methoxyphenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine has a molecular weight of 338.25 g/mol, XLogP of 4.36, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-methoxyphenyl)-4-methyl-1-(2-methylpropyl)imidazol-2-amine is sourced from PubChem (CID 106569054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).