N-(5-bromo-4-fluoro-2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine

C10H11BrFN3 — CID 107591814

IUPACN-(5-bromo-4-fluoro-2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCc1cc(F)c(Br)cc1NC1=NCCN1
InChIInChI=1S/C10H11BrFN3/c1-6-4-8(12)7(11)5-9(6)15-10-13-2-3-14-10/h4-5H,2-3H2,1H3,(H2,13,14,15)
InChIKeyVCKCFFDBDJEOON-UHFFFAOYSA-N
MW272.12 g/mol
LogP2.27
Rot. Bonds1

About N-(5-bromo-4-fluoro-2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine

N-(5-bromo-4-fluoro-2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 107591814) has the molecular formula C10H11BrFN3 and a molecular weight of 272.12 g/mol. Its IUPAC name is N-(5-bromo-4-fluoro-2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-(5-bromo-4-fluoro-2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine
PubChem CID107591814
Molecular FormulaC10H11BrFN3
Molecular Weight272.12 g/mol
Exact Mass271.01
IUPAC NameN-(5-bromo-4-fluoro-2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCc1cc(F)c(Br)cc1NC1=NCCN1
InChIInChI=1S/C10H11BrFN3/c1-6-4-8(12)7(11)5-9(6)15-10-13-2-3-14-10/h4-5H,2-3H2,1H3,(H2,13,14,15)
InChIKeyVCKCFFDBDJEOON-UHFFFAOYSA-N
XLogP2.27
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.12
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-bromo-2,3-dimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine
CID 59922099
N-(3-bromo-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine
CID 114400222
N-(2-bromo-3-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine
CID 86008018
N-(3-fluoro-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine
CID 3088359
N-(2-bromo-3-chloro-5-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine
CID 59922089
N-(2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride
CID 90678855
3,5-dibromo-N-(5-bromo-4-fluoro-2-methylphenyl)pyridin-2-amine
CID 107593871
N-(5-bromo-4-fluoro-2-methylphenyl)-2,3,5,6-tetrafluoropyridin-4-amine
CID 107593334
5-bromo-4-(5-bromo-4-fluoro-2-methylanilino)-1H-pyrimidin-6-one
CID 136697012
N-[2-(2,6-difluorophenyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine
CID 15175561
4-chloro-3-N-(4,5-dihydro-1H-imidazol-2-yl)-6-fluorobenzene-1,3-diamine
CID 139945187
N-(2-bromo-6-chloro-4-fluorophenyl)-4,5-dihydro-1H-imidazol-2-amine
CID 107611250

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-4-fluoro-2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of N-(5-bromo-4-fluoro-2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine (CID 107591814) is N-(5-bromo-4-fluoro-2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for N-(5-bromo-4-fluoro-2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for N-(5-bromo-4-fluoro-2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine is Cc1cc(F)c(Br)cc1NC1=NCCN1.
What is the InChIKey of N-(5-bromo-4-fluoro-2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is VCKCFFDBDJEOON-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrFN3/c1-6-4-8(12)7(11)5-9(6)15-10-13-2-3-14-10/h4-5H,2-3H2,1H3,(H2,13,14,15).
What are the key properties of N-(5-bromo-4-fluoro-2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine?
N-(5-bromo-4-fluoro-2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 272.12 g/mol, XLogP of 2.27, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-4-fluoro-2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 107591814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).