N-(2-chloro-6-fluorophenyl)-1-(2-methylpropyl)imidazol-2-amine

C13H15ClFN3 — CID 106582336

IUPACN-(2-chloro-6-fluorophenyl)-1-(2-methylpropyl)imidazol-2-amine
SMILESCC(C)Cn1ccnc1Nc1c(F)cccc1Cl
InChIInChI=1S/C13H15ClFN3/c1-9(2)8-18-7-6-16-13(18)17-12-10(14)4-3-5-11(12)15/h3-7,9H,8H2,1-2H3,(H,16,17)
InChIKeyCLISKUBFXAQKHC-UHFFFAOYSA-N
MW267.74 g/mol
LogP4.08
Rot. Bonds4

About N-(2-chloro-6-fluorophenyl)-1-(2-methylpropyl)imidazol-2-amine

N-(2-chloro-6-fluorophenyl)-1-(2-methylpropyl)imidazol-2-amine (PubChem CID 106582336) has the molecular formula C13H15ClFN3 and a molecular weight of 267.74 g/mol. Its IUPAC name is N-(2-chloro-6-fluorophenyl)-1-(2-methylpropyl)imidazol-2-amine.

Molecular Properties

Compound NameN-(2-chloro-6-fluorophenyl)-1-(2-methylpropyl)imidazol-2-amine
PubChem CID106582336
Molecular FormulaC13H15ClFN3
Molecular Weight267.74 g/mol
Exact Mass267.09
IUPAC NameN-(2-chloro-6-fluorophenyl)-1-(2-methylpropyl)imidazol-2-amine
SMILESCC(C)Cn1ccnc1Nc1c(F)cccc1Cl
InChIInChI=1S/C13H15ClFN3/c1-9(2)8-18-7-6-16-13(18)17-12-10(14)4-3-5-11(12)15/h3-7,9H,8H2,1-2H3,(H,16,17)
InChIKeyCLISKUBFXAQKHC-UHFFFAOYSA-N
XLogP4.08
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.74
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-chloro-6-fluorophenyl)-1-(2-methylpropyl)imidazol-2-amine with MolForge

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

Launch Full Analysis

Related Compounds

N-(2-chloro-6-fluorophenyl)-1-methylimidazol-2-amine
CID 106582347
N-(4-chloro-2-fluorophenyl)-1-(2-methylpropyl)imidazol-2-amine
CID 106568967
N-(2,4-dichlorophenyl)-1-(2-methylpropyl)imidazol-2-amine
CID 106556363
N-(2-chloro-6-fluorophenyl)-1-cyclopentylimidazol-2-amine
CID 106582343
N-(2-bromo-6-fluorophenyl)-1-propylimidazol-2-amine
CID 107605154
1-(2-methylpropyl)-N-[3-(trifluoromethyl)phenyl]imidazol-2-amine
CID 106556215
N-[(2-chloro-4-fluorophenyl)methyl]-1-(2-methylpropyl)imidazol-2-amine
CID 100663003
N-(2-bromo-5-chloro-4-methylphenyl)-1-(2-methylpropyl)imidazol-2-amine
CID 106580673
N-(2-chloro-6-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine
CID 106576265
N-(2-fluoro-6-methylphenyl)-1-(3-methoxypropyl)imidazol-2-amine
CID 106581649
1-(2-methylpropyl)-N-(4-propylphenyl)imidazol-2-amine
CID 106561544
N-(2,6-dichlorophenyl)-2-[methyl-[4-(2-methylpropyl)-3-oxopyrazin-2-yl]amino]acetamide
CID 133424150

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-6-fluorophenyl)-1-(2-methylpropyl)imidazol-2-amine?
The IUPAC name of N-(2-chloro-6-fluorophenyl)-1-(2-methylpropyl)imidazol-2-amine (CID 106582336) is N-(2-chloro-6-fluorophenyl)-1-(2-methylpropyl)imidazol-2-amine.
What is the SMILES notation for N-(2-chloro-6-fluorophenyl)-1-(2-methylpropyl)imidazol-2-amine?
The canonical SMILES for N-(2-chloro-6-fluorophenyl)-1-(2-methylpropyl)imidazol-2-amine is CC(C)Cn1ccnc1Nc1c(F)cccc1Cl.
What is the InChIKey of N-(2-chloro-6-fluorophenyl)-1-(2-methylpropyl)imidazol-2-amine?
The InChIKey is CLISKUBFXAQKHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClFN3/c1-9(2)8-18-7-6-16-13(18)17-12-10(14)4-3-5-11(12)15/h3-7,9H,8H2,1-2H3,(H,16,17).
What are the key properties of N-(2-chloro-6-fluorophenyl)-1-(2-methylpropyl)imidazol-2-amine?
N-(2-chloro-6-fluorophenyl)-1-(2-methylpropyl)imidazol-2-amine has a molecular weight of 267.74 g/mol, XLogP of 4.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-6-fluorophenyl)-1-(2-methylpropyl)imidazol-2-amine is sourced from PubChem (CID 106582336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).