N-(2,6-dichlorophenyl)-5-methyl-4,5-dihydro-1H-imidazol-2-amine

C10H11Cl2N3 — CID 12699315

IUPACN-(2,6-dichlorophenyl)-5-methyl-4,5-dihydro-1H-imidazol-2-amine
SMILESCC1CN=C(Nc2c(Cl)cccc2Cl)N1
InChIInChI=1S/C10H11Cl2N3/c1-6-5-13-10(14-6)15-9-7(11)3-2-4-8(9)12/h2-4,6H,5H2,1H3,(H2,13,14,15)
InChIKeyITKQNORKNISIMB-UHFFFAOYSA-N
MW244.12 g/mol
LogP2.75
Rot. Bonds1

About N-(2,6-dichlorophenyl)-5-methyl-4,5-dihydro-1H-imidazol-2-amine

N-(2,6-dichlorophenyl)-5-methyl-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 12699315) has the molecular formula C10H11Cl2N3 and a molecular weight of 244.12 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-5-methyl-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-5-methyl-4,5-dihydro-1H-imidazol-2-amine
PubChem CID12699315
Molecular FormulaC10H11Cl2N3
Molecular Weight244.12 g/mol
Exact Mass243.03
IUPAC NameN-(2,6-dichlorophenyl)-5-methyl-4,5-dihydro-1H-imidazol-2-amine
SMILESCC1CN=C(Nc2c(Cl)cccc2Cl)N1
InChIInChI=1S/C10H11Cl2N3/c1-6-5-13-10(14-6)15-9-7(11)3-2-4-8(9)12/h2-4,6H,5H2,1H3,(H2,13,14,15)
InChIKeyITKQNORKNISIMB-UHFFFAOYSA-N
XLogP2.75
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.12
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-5-methyl-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of N-(2,6-dichlorophenyl)-5-methyl-4,5-dihydro-1H-imidazol-2-amine (CID 12699315) is N-(2,6-dichlorophenyl)-5-methyl-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for N-(2,6-dichlorophenyl)-5-methyl-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for N-(2,6-dichlorophenyl)-5-methyl-4,5-dihydro-1H-imidazol-2-amine is CC1CN=C(Nc2c(Cl)cccc2Cl)N1.
What is the InChIKey of N-(2,6-dichlorophenyl)-5-methyl-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is ITKQNORKNISIMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11Cl2N3/c1-6-5-13-10(14-6)15-9-7(11)3-2-4-8(9)12/h2-4,6H,5H2,1H3,(H2,13,14,15).
What are the key properties of N-(2,6-dichlorophenyl)-5-methyl-4,5-dihydro-1H-imidazol-2-amine?
N-(2,6-dichlorophenyl)-5-methyl-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 244.12 g/mol, XLogP of 2.75, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-5-methyl-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 12699315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).