5-(5-chloro-2-fluorophenyl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine

C16H15ClFN3 — CID 114867764

IUPAC5-(5-chloro-2-fluorophenyl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine
SMILESCc1cccc(N2C(N)=NCC2c2cc(Cl)ccc2F)c1
InChIInChI=1S/C16H15ClFN3/c1-10-3-2-4-12(7-10)21-15(9-20-16(21)19)13-8-11(17)5-6-14(13)18/h2-8,15H,9H2,1H3,(H2,19,20)
InChIKeyRNBRFWJANUPLHO-UHFFFAOYSA-N
MW303.77 g/mol
LogP3.66
Rot. Bonds2

About 5-(5-chloro-2-fluorophenyl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine

5-(5-chloro-2-fluorophenyl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine (PubChem CID 114867764) has the molecular formula C16H15ClFN3 and a molecular weight of 303.77 g/mol. Its IUPAC name is 5-(5-chloro-2-fluorophenyl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name5-(5-chloro-2-fluorophenyl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine
PubChem CID114867764
Molecular FormulaC16H15ClFN3
Molecular Weight303.77 g/mol
Exact Mass303.09
IUPAC Name5-(5-chloro-2-fluorophenyl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine
SMILESCc1cccc(N2C(N)=NCC2c2cc(Cl)ccc2F)c1
InChIInChI=1S/C16H15ClFN3/c1-10-3-2-4-12(7-10)21-15(9-20-16(21)19)13-8-11(17)5-6-14(13)18/h2-8,15H,9H2,1H3,(H2,19,20)
InChIKeyRNBRFWJANUPLHO-UHFFFAOYSA-N
XLogP3.66
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.77
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(5-chloro-2-fluorophenyl)-1-(3-chlorophenyl)-4,5-dihydroimidazol-2-amine
CID 114867752
1-(3-chlorophenyl)-5-(2,4-difluorophenyl)-4,5-dihydroimidazol-2-amine
CID 79500440
5-(5-chloro-2-fluorophenyl)-1-methyl-4,5-dihydroimidazol-2-amine
CID 114867691
5-(2-fluorophenyl)-1-(3-fluorophenyl)-4,5-dihydroimidazol-2-amine
CID 79515210
5-(5-chloro-1,3-thiazol-2-yl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine
CID 107126041
5-methyl-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine
CID 79504921
1-(3-methylphenyl)-5-thiophen-2-yl-4,5-dihydroimidazol-2-amine
CID 79505674
5-(2-chlorophenyl)-1-(3-fluorophenyl)-4,5-dihydroimidazol-2-amine
CID 79514500
5-(2,5-difluorophenyl)-1-(4-fluorophenyl)-4,5-dihydroimidazol-2-amine
CID 79499543
1-(4-chlorophenyl)-5-(2,4-difluorophenyl)-4,5-dihydroimidazol-2-amine
CID 79502211
1-(3-chlorophenyl)-5-(2,6-dichlorophenyl)-4,5-dihydroimidazol-2-amine
CID 79499183
5-(3-chlorophenyl)-1-(4-methylphenyl)-4,5-dihydroimidazol-2-amine
CID 79505392

Frequently Asked Questions

What is the IUPAC name of 5-(5-chloro-2-fluorophenyl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of 5-(5-chloro-2-fluorophenyl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine (CID 114867764) is 5-(5-chloro-2-fluorophenyl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 5-(5-chloro-2-fluorophenyl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 5-(5-chloro-2-fluorophenyl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine is Cc1cccc(N2C(N)=NCC2c2cc(Cl)ccc2F)c1.
What is the InChIKey of 5-(5-chloro-2-fluorophenyl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine?
The InChIKey is RNBRFWJANUPLHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClFN3/c1-10-3-2-4-12(7-10)21-15(9-20-16(21)19)13-8-11(17)5-6-14(13)18/h2-8,15H,9H2,1H3,(H2,19,20).
What are the key properties of 5-(5-chloro-2-fluorophenyl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine?
5-(5-chloro-2-fluorophenyl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine has a molecular weight of 303.77 g/mol, XLogP of 3.66, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-chloro-2-fluorophenyl)-1-(3-methylphenyl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 114867764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).