N-(2,6-dichloro-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride

C10H12Cl3N3 — CID 90678845

IUPACN-(2,6-dichloro-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride
SMILESCc1cc(Cl)c(NC2=NCCN2)c(Cl)c1.Cl
InChIInChI=1S/C10H11Cl2N3.ClH/c1-6-4-7(11)9(8(12)5-6)15-10-13-2-3-14-10;/h4-5H,2-3H2,1H3,(H2,13,14,15);1H
InChIKeyOKJYEYWPLISJAS-UHFFFAOYSA-N
MW280.59 g/mol
LogP3.09
Rot. Bonds1

About N-(2,6-dichloro-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride

N-(2,6-dichloro-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride (PubChem CID 90678845) has the molecular formula C10H12Cl3N3 and a molecular weight of 280.59 g/mol. Its IUPAC name is N-(2,6-dichloro-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride.

Molecular Properties

Compound NameN-(2,6-dichloro-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride
PubChem CID90678845
Molecular FormulaC10H12Cl3N3
Molecular Weight280.59 g/mol
Exact Mass279.01
IUPAC NameN-(2,6-dichloro-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride
SMILESCc1cc(Cl)c(NC2=NCCN2)c(Cl)c1.Cl
InChIInChI=1S/C10H11Cl2N3.ClH/c1-6-4-7(11)9(8(12)5-6)15-10-13-2-3-14-10;/h4-5H,2-3H2,1H3,(H2,13,14,15);1H
InChIKeyOKJYEYWPLISJAS-UHFFFAOYSA-N
XLogP3.09
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.59
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2,6-dichloro-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichloro-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride?
The IUPAC name of N-(2,6-dichloro-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride (CID 90678845) is N-(2,6-dichloro-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride.
What is the SMILES notation for N-(2,6-dichloro-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride?
The canonical SMILES for N-(2,6-dichloro-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride is Cc1cc(Cl)c(NC2=NCCN2)c(Cl)c1.Cl.
What is the InChIKey of N-(2,6-dichloro-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride?
The InChIKey is OKJYEYWPLISJAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11Cl2N3.ClH/c1-6-4-7(11)9(8(12)5-6)15-10-13-2-3-14-10;/h4-5H,2-3H2,1H3,(H2,13,14,15);1H.
What are the key properties of N-(2,6-dichloro-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride?
N-(2,6-dichloro-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride has a molecular weight of 280.59 g/mol, XLogP of 3.09, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichloro-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride is sourced from PubChem (CID 90678845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).