N-(2-bromo-3-chloro-5-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine

C10H11BrClN3 — CID 59922089

IUPACN-(2-bromo-3-chloro-5-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCc1cc(Cl)c(Br)c(NC2=NCCN2)c1
InChIInChI=1S/C10H11BrClN3/c1-6-4-7(12)9(11)8(5-6)15-10-13-2-3-14-10/h4-5H,2-3H2,1H3,(H2,13,14,15)
InChIKeySVESUYWSSQBPRD-UHFFFAOYSA-N
MW288.58 g/mol
LogP2.78
Rot. Bonds1

About N-(2-bromo-3-chloro-5-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine

N-(2-bromo-3-chloro-5-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 59922089) has the molecular formula C10H11BrClN3 and a molecular weight of 288.58 g/mol. Its IUPAC name is N-(2-bromo-3-chloro-5-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-(2-bromo-3-chloro-5-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine
PubChem CID59922089
Molecular FormulaC10H11BrClN3
Molecular Weight288.58 g/mol
Exact Mass286.98
IUPAC NameN-(2-bromo-3-chloro-5-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCc1cc(Cl)c(Br)c(NC2=NCCN2)c1
InChIInChI=1S/C10H11BrClN3/c1-6-4-7(12)9(11)8(5-6)15-10-13-2-3-14-10/h4-5H,2-3H2,1H3,(H2,13,14,15)
InChIKeySVESUYWSSQBPRD-UHFFFAOYSA-N
XLogP2.78
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.58
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,4,6-trimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine
CID 10354248
N-(4-bromo-2,3-dimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine
CID 59922099
N-(5-bromo-4-fluoro-2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine
CID 107591814
2,6-dichloro-1-N-(4,5-dihydro-1H-imidazol-2-yl)benzene-1,4-diamine
CID 138491779
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
N-[4-bromo-2-(trifluoromethoxy)phenyl]-4,5-dihydro-1H-imidazol-2-amine
CID 103193106
N-(2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride
CID 90678855
N-(3-bromo-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine
CID 114400222
4-bromo-6-chloro-1-N-(4,5-dihydro-1H-imidazol-2-yl)-2-fluorobenzene-1,3-diamine
CID 139945191
2-chloro-3-N-(4,5-dihydro-1H-imidazol-2-yl)benzene-1,3-diamine
CID 125427077
5-bromo-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine;2,6-dichloro-1-N-(4,5-dihydro-1H-imidazol-2-yl)-4-N-phosphanylbenzene-1,4-diamine
CID 162089581

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-3-chloro-5-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of N-(2-bromo-3-chloro-5-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine (CID 59922089) is N-(2-bromo-3-chloro-5-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for N-(2-bromo-3-chloro-5-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for N-(2-bromo-3-chloro-5-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine is Cc1cc(Cl)c(Br)c(NC2=NCCN2)c1.
What is the InChIKey of N-(2-bromo-3-chloro-5-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is SVESUYWSSQBPRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrClN3/c1-6-4-7(12)9(11)8(5-6)15-10-13-2-3-14-10/h4-5H,2-3H2,1H3,(H2,13,14,15).
What are the key properties of N-(2-bromo-3-chloro-5-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine?
N-(2-bromo-3-chloro-5-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 288.58 g/mol, XLogP of 2.78, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-3-chloro-5-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 59922089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).