1-cyclopropyl-N-[2-(4-fluoro-2-methylphenyl)ethyl]-4-methylimidazol-2-amine

C16H20FN3 — CID 106576890

IUPAC1-cyclopropyl-N-[2-(4-fluoro-2-methylphenyl)ethyl]-4-methylimidazol-2-amine
SMILESCc1cn(C2CC2)c(NCCc2ccc(F)cc2C)n1
InChIInChI=1S/C16H20FN3/c1-11-9-14(17)4-3-13(11)7-8-18-16-19-12(2)10-20(16)15-5-6-15/h3-4,9-10,15H,5-8H2,1-2H3,(H,18,19)
InChIKeyYGECYZQLNHVQDB-UHFFFAOYSA-N
MW273.35 g/mol
LogP3.63
Rot. Bonds5

About 1-cyclopropyl-N-[2-(4-fluoro-2-methylphenyl)ethyl]-4-methylimidazol-2-amine

1-cyclopropyl-N-[2-(4-fluoro-2-methylphenyl)ethyl]-4-methylimidazol-2-amine (PubChem CID 106576890) has the molecular formula C16H20FN3 and a molecular weight of 273.35 g/mol. Its IUPAC name is 1-cyclopropyl-N-[2-(4-fluoro-2-methylphenyl)ethyl]-4-methylimidazol-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-[2-(4-fluoro-2-methylphenyl)ethyl]-4-methylimidazol-2-amine
PubChem CID106576890
Molecular FormulaC16H20FN3
Molecular Weight273.35 g/mol
Exact Mass273.16
IUPAC Name1-cyclopropyl-N-[2-(4-fluoro-2-methylphenyl)ethyl]-4-methylimidazol-2-amine
SMILESCc1cn(C2CC2)c(NCCc2ccc(F)cc2C)n1
InChIInChI=1S/C16H20FN3/c1-11-9-14(17)4-3-13(11)7-8-18-16-19-12(2)10-20(16)15-5-6-15/h3-4,9-10,15H,5-8H2,1-2H3,(H,18,19)
InChIKeyYGECYZQLNHVQDB-UHFFFAOYSA-N
XLogP3.63
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.35
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-cyclopropyl-N-[2-(4-fluoro-2-methylphenyl)ethyl]-4-methylimidazol-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

1-cyclopropyl-N-[2-(3-fluorophenyl)ethyl]-4-methylimidazol-2-amine
CID 106562530
1-cyclopentyl-N-(5-fluoro-2-methylphenyl)-4-methylimidazol-2-amine
CID 106559274
1-cyclopropyl-N-(4-fluoro-2-iodophenyl)-4-methylimidazol-2-amine
CID 106576412
1-cyclohexyl-N-[(3-fluorophenyl)methyl]-4-methylimidazol-2-amine
CID 106560930
3,5-dichloro-N-[2-(4-fluoro-2-methylphenyl)ethyl]-6-hydrazinylpyridin-2-amine
CID 102762299
1-cyclooctyl-4-methyl-N-propylimidazol-2-amine
CID 106557157
4-N-[2-(4-fluoro-2-methylphenyl)ethyl]-2-methylpyrimidine-4,6-diamine
CID 80852017
N-[2-(4-fluoro-2-methylphenyl)ethyl]-6-hydrazinyl-2-methylpyrimidin-4-amine
CID 80926608
2-[2-(4-fluoro-2-methylphenyl)ethylamino]-6-methylpyrimidine-4-carbonitrile
CID 107544870
N-(2-cyclohexylethyl)-1-cyclopentyl-4-methylimidazol-2-amine
CID 106563352
1-cyclohexyl-4-methyl-N-(3-methylbutyl)imidazol-2-amine
CID 106557289
1-cyclopropyl-4-methyl-N-[2-(2-methylpropoxy)ethyl]imidazol-2-amine
CID 106582379

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[2-(4-fluoro-2-methylphenyl)ethyl]-4-methylimidazol-2-amine?
The IUPAC name of 1-cyclopropyl-N-[2-(4-fluoro-2-methylphenyl)ethyl]-4-methylimidazol-2-amine (CID 106576890) is 1-cyclopropyl-N-[2-(4-fluoro-2-methylphenyl)ethyl]-4-methylimidazol-2-amine.
What is the SMILES notation for 1-cyclopropyl-N-[2-(4-fluoro-2-methylphenyl)ethyl]-4-methylimidazol-2-amine?
The canonical SMILES for 1-cyclopropyl-N-[2-(4-fluoro-2-methylphenyl)ethyl]-4-methylimidazol-2-amine is Cc1cn(C2CC2)c(NCCc2ccc(F)cc2C)n1.
What is the InChIKey of 1-cyclopropyl-N-[2-(4-fluoro-2-methylphenyl)ethyl]-4-methylimidazol-2-amine?
The InChIKey is YGECYZQLNHVQDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FN3/c1-11-9-14(17)4-3-13(11)7-8-18-16-19-12(2)10-20(16)15-5-6-15/h3-4,9-10,15H,5-8H2,1-2H3,(H,18,19).
What are the key properties of 1-cyclopropyl-N-[2-(4-fluoro-2-methylphenyl)ethyl]-4-methylimidazol-2-amine?
1-cyclopropyl-N-[2-(4-fluoro-2-methylphenyl)ethyl]-4-methylimidazol-2-amine has a molecular weight of 273.35 g/mol, XLogP of 3.63, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[2-(4-fluoro-2-methylphenyl)ethyl]-4-methylimidazol-2-amine is sourced from PubChem (CID 106576890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).