2,3-diethyl-5-(4-fluoro-2-methylphenyl)imidazol-4-amine

C14H18FN3 — CID 62226570

IUPAC2,3-diethyl-5-(4-fluoro-2-methylphenyl)imidazol-4-amine
SMILESCCc1nc(-c2ccc(F)cc2C)c(N)n1CC
InChIInChI=1S/C14H18FN3/c1-4-12-17-13(14(16)18(12)5-2)11-7-6-10(15)8-9(11)3/h6-8H,4-5,16H2,1-3H3
InChIKeySWDVWJRIULYOTD-UHFFFAOYSA-N
MW247.32 g/mol
LogP3.16
Rot. Bonds3

About 2,3-diethyl-5-(4-fluoro-2-methylphenyl)imidazol-4-amine

2,3-diethyl-5-(4-fluoro-2-methylphenyl)imidazol-4-amine (PubChem CID 62226570) has the molecular formula C14H18FN3 and a molecular weight of 247.32 g/mol. Its IUPAC name is 2,3-diethyl-5-(4-fluoro-2-methylphenyl)imidazol-4-amine.

Molecular Properties

Compound Name2,3-diethyl-5-(4-fluoro-2-methylphenyl)imidazol-4-amine
PubChem CID62226570
Molecular FormulaC14H18FN3
Molecular Weight247.32 g/mol
Exact Mass247.15
IUPAC Name2,3-diethyl-5-(4-fluoro-2-methylphenyl)imidazol-4-amine
SMILESCCc1nc(-c2ccc(F)cc2C)c(N)n1CC
InChIInChI=1S/C14H18FN3/c1-4-12-17-13(14(16)18(12)5-2)11-7-6-10(15)8-9(11)3/h6-8H,4-5,16H2,1-3H3
InChIKeySWDVWJRIULYOTD-UHFFFAOYSA-N
XLogP3.16
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.32
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2-bromo-5-fluorophenyl)-2,3-diethylimidazol-4-amine
CID 114078062
5-(2-bromo-4-fluorophenyl)-3-ethyl-2-methylimidazol-4-amine
CID 114060782
5-(2-chlorophenyl)-2,3-diethylimidazol-4-amine
CID 55049007
2,3-diethyl-5-(3-methylphenyl)imidazol-4-amine
CID 62225267
2,3-diethyl-5-(6-methyl-3-pyridinyl)imidazol-4-amine
CID 113457242
5-(5-chloroquinolin-8-yl)-2,3-diethylimidazol-4-amine
CID 115960255
3-cyclopropyl-5-(4-fluoro-2-methylphenyl)-2-methylimidazol-4-amine
CID 62225965
5-(4-fluoro-2-methylphenyl)-2,3-di(propan-2-yl)imidazol-4-amine
CID 62219616
2-(4-fluoro-2-methylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 55249543
5-(3,5-dichlorophenyl)-2,3-diethylimidazol-4-amine
CID 62226580
2,3-diethyl-5-naphthalen-2-ylimidazol-4-amine
CID 62225265
5-(2,4-difluorophenyl)-3-(2-methylpropyl)-2-propylimidazol-4-amine
CID 62218894

Frequently Asked Questions

What is the IUPAC name of 2,3-diethyl-5-(4-fluoro-2-methylphenyl)imidazol-4-amine?
The IUPAC name of 2,3-diethyl-5-(4-fluoro-2-methylphenyl)imidazol-4-amine (CID 62226570) is 2,3-diethyl-5-(4-fluoro-2-methylphenyl)imidazol-4-amine.
What is the SMILES notation for 2,3-diethyl-5-(4-fluoro-2-methylphenyl)imidazol-4-amine?
The canonical SMILES for 2,3-diethyl-5-(4-fluoro-2-methylphenyl)imidazol-4-amine is CCc1nc(-c2ccc(F)cc2C)c(N)n1CC.
What is the InChIKey of 2,3-diethyl-5-(4-fluoro-2-methylphenyl)imidazol-4-amine?
The InChIKey is SWDVWJRIULYOTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FN3/c1-4-12-17-13(14(16)18(12)5-2)11-7-6-10(15)8-9(11)3/h6-8H,4-5,16H2,1-3H3.
What are the key properties of 2,3-diethyl-5-(4-fluoro-2-methylphenyl)imidazol-4-amine?
2,3-diethyl-5-(4-fluoro-2-methylphenyl)imidazol-4-amine has a molecular weight of 247.32 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-diethyl-5-(4-fluoro-2-methylphenyl)imidazol-4-amine is sourced from PubChem (CID 62226570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).