N-(3-chloro-5-fluorophenyl)-1-cyclopentyl-4-methylimidazol-2-amine

C15H17ClFN3 — CID 107371322

IUPACN-(3-chloro-5-fluorophenyl)-1-cyclopentyl-4-methylimidazol-2-amine
SMILESCc1cn(C2CCCC2)c(Nc2cc(F)cc(Cl)c2)n1
InChIInChI=1S/C15H17ClFN3/c1-10-9-20(14-4-2-3-5-14)15(18-10)19-13-7-11(16)6-12(17)8-13/h6-9,14H,2-5H2,1H3,(H,18,19)
InChIKeyOGEJKKYAYMTURG-UHFFFAOYSA-N
MW293.77 g/mol
LogP4.84
Rot. Bonds3

About N-(3-chloro-5-fluorophenyl)-1-cyclopentyl-4-methylimidazol-2-amine

N-(3-chloro-5-fluorophenyl)-1-cyclopentyl-4-methylimidazol-2-amine (PubChem CID 107371322) has the molecular formula C15H17ClFN3 and a molecular weight of 293.77 g/mol. Its IUPAC name is N-(3-chloro-5-fluorophenyl)-1-cyclopentyl-4-methylimidazol-2-amine.

Molecular Properties

Compound NameN-(3-chloro-5-fluorophenyl)-1-cyclopentyl-4-methylimidazol-2-amine
PubChem CID107371322
Molecular FormulaC15H17ClFN3
Molecular Weight293.77 g/mol
Exact Mass293.11
IUPAC NameN-(3-chloro-5-fluorophenyl)-1-cyclopentyl-4-methylimidazol-2-amine
SMILESCc1cn(C2CCCC2)c(Nc2cc(F)cc(Cl)c2)n1
InChIInChI=1S/C15H17ClFN3/c1-10-9-20(14-4-2-3-5-14)15(18-10)19-13-7-11(16)6-12(17)8-13/h6-9,14H,2-5H2,1H3,(H,18,19)
InChIKeyOGEJKKYAYMTURG-UHFFFAOYSA-N
XLogP4.84
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.77
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopentyl-N-(2,6-dichloro-4-fluorophenyl)-4-methylimidazol-2-amine
CID 106578790
1-cyclohexyl-N-(3,4-difluorophenyl)-4-methylimidazol-2-amine
CID 106558163
N-(3-chloro-5-fluorophenyl)-1-cyclohexylimidazol-2-amine
CID 107371348
N-(1-cyclopropyl-4-methylimidazol-2-yl)-5-fluoropyridin-3-amine
CID 114254403
N-(4-bromo-3-fluorophenyl)-1-cyclohexyl-4-methylimidazol-2-amine
CID 106574225
1-cyclopentyl-N-(5-fluoro-2-methylphenyl)-4-methylimidazol-2-amine
CID 106559274
N-(5-chloro-2-methylphenyl)-1-cyclohexyl-4-methylimidazol-2-amine
CID 106560607
1-cyclopentyl-N-(3-fluoro-4-methoxyphenyl)-4-methylimidazol-2-amine
CID 106561849
1-cyclohexyl-N-(2,6-dichlorophenyl)-4-methylimidazol-2-amine
CID 106574142
1-cyclohexyl-N-(3-fluoro-2-methylphenyl)-4-methylimidazol-2-amine
CID 106564039
1-cyclopropyl-N-[4-fluoro-3-(trifluoromethyl)phenyl]-4-methylimidazol-2-amine
CID 106563755
N-(4-bromo-3-methylphenyl)-1-cyclohexyl-4-methylimidazol-2-amine
CID 106557012

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-5-fluorophenyl)-1-cyclopentyl-4-methylimidazol-2-amine?
The IUPAC name of N-(3-chloro-5-fluorophenyl)-1-cyclopentyl-4-methylimidazol-2-amine (CID 107371322) is N-(3-chloro-5-fluorophenyl)-1-cyclopentyl-4-methylimidazol-2-amine.
What is the SMILES notation for N-(3-chloro-5-fluorophenyl)-1-cyclopentyl-4-methylimidazol-2-amine?
The canonical SMILES for N-(3-chloro-5-fluorophenyl)-1-cyclopentyl-4-methylimidazol-2-amine is Cc1cn(C2CCCC2)c(Nc2cc(F)cc(Cl)c2)n1.
What is the InChIKey of N-(3-chloro-5-fluorophenyl)-1-cyclopentyl-4-methylimidazol-2-amine?
The InChIKey is OGEJKKYAYMTURG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClFN3/c1-10-9-20(14-4-2-3-5-14)15(18-10)19-13-7-11(16)6-12(17)8-13/h6-9,14H,2-5H2,1H3,(H,18,19).
What are the key properties of N-(3-chloro-5-fluorophenyl)-1-cyclopentyl-4-methylimidazol-2-amine?
N-(3-chloro-5-fluorophenyl)-1-cyclopentyl-4-methylimidazol-2-amine has a molecular weight of 293.77 g/mol, XLogP of 4.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-5-fluorophenyl)-1-cyclopentyl-4-methylimidazol-2-amine is sourced from PubChem (CID 107371322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).