N-(2-chloro-6-fluorophenyl)-1-methylimidazol-2-amine

C10H9ClFN3 — CID 106582347

IUPACN-(2-chloro-6-fluorophenyl)-1-methylimidazol-2-amine
SMILESCn1ccnc1Nc1c(F)cccc1Cl
InChIInChI=1S/C10H9ClFN3/c1-15-6-5-13-10(15)14-9-7(11)3-2-4-8(9)12/h2-6H,1H3,(H,13,14)
InChIKeyYSVBFJKLBSQUBV-UHFFFAOYSA-N
MW225.65 g/mol
LogP2.96
Rot. Bonds2

About N-(2-chloro-6-fluorophenyl)-1-methylimidazol-2-amine

N-(2-chloro-6-fluorophenyl)-1-methylimidazol-2-amine (PubChem CID 106582347) has the molecular formula C10H9ClFN3 and a molecular weight of 225.65 g/mol. Its IUPAC name is N-(2-chloro-6-fluorophenyl)-1-methylimidazol-2-amine.

Molecular Properties

Compound NameN-(2-chloro-6-fluorophenyl)-1-methylimidazol-2-amine
PubChem CID106582347
Molecular FormulaC10H9ClFN3
Molecular Weight225.65 g/mol
Exact Mass225.05
IUPAC NameN-(2-chloro-6-fluorophenyl)-1-methylimidazol-2-amine
SMILESCn1ccnc1Nc1c(F)cccc1Cl
InChIInChI=1S/C10H9ClFN3/c1-15-6-5-13-10(15)14-9-7(11)3-2-4-8(9)12/h2-6H,1H3,(H,13,14)
InChIKeyYSVBFJKLBSQUBV-UHFFFAOYSA-N
XLogP2.96
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.65
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-chloro-6-fluorophenyl)-1-(2-methylpropyl)imidazol-2-amine
CID 106582336
N-(2-chloro-6-fluorophenyl)-1-cyclopentylimidazol-2-amine
CID 106582343
2-(2-chloro-6-fluorophenyl)-1-methylimidazole
CID 82077992
N-(3-chlorophenyl)-1-methylimidazol-2-amine
CID 68890475
N-(2-bromo-4,6-difluorophenyl)-1-methylimidazol-2-amine
CID 106561368
1-methyl-N-(2,4,5-trichlorophenyl)imidazol-2-amine
CID 106556588
N-(2-bromo-6-fluorophenyl)-1-propylimidazol-2-amine
CID 107605154
2,6-difluoro-N-[(1-methylimidazol-2-yl)methyl]aniline
CID 43088131
1-(4-chloro-5-methyl-2-pyridinyl)-N-(2,6-dichlorophenyl)imidazol-2-amine
CID 174633974
[(2-chloro-6-fluorophenyl)-(1-methylimidazol-2-yl)methyl]hydrazine
CID 105308170
5-bromo-4-N-(2-chloro-6-fluorophenyl)-6-N-methylpyrimidine-4,6-diamine
CID 114072824
N-(4-bromo-3-fluorophenyl)-1-methylimidazol-2-amine
CID 106574267

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-6-fluorophenyl)-1-methylimidazol-2-amine?
The IUPAC name of N-(2-chloro-6-fluorophenyl)-1-methylimidazol-2-amine (CID 106582347) is N-(2-chloro-6-fluorophenyl)-1-methylimidazol-2-amine.
What is the SMILES notation for N-(2-chloro-6-fluorophenyl)-1-methylimidazol-2-amine?
The canonical SMILES for N-(2-chloro-6-fluorophenyl)-1-methylimidazol-2-amine is Cn1ccnc1Nc1c(F)cccc1Cl.
What is the InChIKey of N-(2-chloro-6-fluorophenyl)-1-methylimidazol-2-amine?
The InChIKey is YSVBFJKLBSQUBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClFN3/c1-15-6-5-13-10(15)14-9-7(11)3-2-4-8(9)12/h2-6H,1H3,(H,13,14).
What are the key properties of N-(2-chloro-6-fluorophenyl)-1-methylimidazol-2-amine?
N-(2-chloro-6-fluorophenyl)-1-methylimidazol-2-amine has a molecular weight of 225.65 g/mol, XLogP of 2.96, 2 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-methylimidazol-2-amine is sourced from PubChem (CID 106582347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).