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

C10H9Cl2N3 — CID 82477662

IUPAC5-(2,4-dichlorophenyl)-2-methyl-1H-imidazol-4-amine
SMILESCc1nc(N)c(-c2ccc(Cl)cc2Cl)[nH]1
InChIInChI=1S/C10H9Cl2N3/c1-5-14-9(10(13)15-5)7-3-2-6(11)4-8(7)12/h2-4H,13H2,1H3,(H,14,15)
InChIKeyQSYKBJSDUQFTOJ-UHFFFAOYSA-N
MW242.11 g/mol
LogP3.27
Rot. Bonds1

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

5-(2,4-dichlorophenyl)-2-methyl-1H-imidazol-4-amine (PubChem CID 82477662) has the molecular formula C10H9Cl2N3 and a molecular weight of 242.11 g/mol. Its IUPAC name is 5-(2,4-dichlorophenyl)-2-methyl-1H-imidazol-4-amine.

Molecular Properties

Compound Name5-(2,4-dichlorophenyl)-2-methyl-1H-imidazol-4-amine
PubChem CID82477662
Molecular FormulaC10H9Cl2N3
Molecular Weight242.11 g/mol
Exact Mass241.02
IUPAC Name5-(2,4-dichlorophenyl)-2-methyl-1H-imidazol-4-amine
SMILESCc1nc(N)c(-c2ccc(Cl)cc2Cl)[nH]1
InChIInChI=1S/C10H9Cl2N3/c1-5-14-9(10(13)15-5)7-3-2-6(11)4-8(7)12/h2-4H,13H2,1H3,(H,14,15)
InChIKeyQSYKBJSDUQFTOJ-UHFFFAOYSA-N
XLogP3.27
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.11
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(2,4-dichlorophenyl)-2-methyl-1H-imidazol-4-amine?
The IUPAC name of 5-(2,4-dichlorophenyl)-2-methyl-1H-imidazol-4-amine (CID 82477662) is 5-(2,4-dichlorophenyl)-2-methyl-1H-imidazol-4-amine.
What is the SMILES notation for 5-(2,4-dichlorophenyl)-2-methyl-1H-imidazol-4-amine?
The canonical SMILES for 5-(2,4-dichlorophenyl)-2-methyl-1H-imidazol-4-amine is Cc1nc(N)c(-c2ccc(Cl)cc2Cl)[nH]1.
What is the InChIKey of 5-(2,4-dichlorophenyl)-2-methyl-1H-imidazol-4-amine?
The InChIKey is QSYKBJSDUQFTOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9Cl2N3/c1-5-14-9(10(13)15-5)7-3-2-6(11)4-8(7)12/h2-4H,13H2,1H3,(H,14,15).
What are the key properties of 5-(2,4-dichlorophenyl)-2-methyl-1H-imidazol-4-amine?
5-(2,4-dichlorophenyl)-2-methyl-1H-imidazol-4-amine has a molecular weight of 242.11 g/mol, XLogP of 3.27, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-dichlorophenyl)-2-methyl-1H-imidazol-4-amine is sourced from PubChem (CID 82477662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).