N-(2-methylpropyl)-1-[2-methyl-5-(trifluoromethyl)phenyl]imidazol-2-amine

C15H18F3N3 — CID 106575920

IUPACN-(2-methylpropyl)-1-[2-methyl-5-(trifluoromethyl)phenyl]imidazol-2-amine
SMILESCc1ccc(C(F)(F)F)cc1-n1ccnc1NCC(C)C
InChIInChI=1S/C15H18F3N3/c1-10(2)9-20-14-19-6-7-21(14)13-8-12(15(16,17)18)5-4-11(13)3/h4-8,10H,9H2,1-3H3,(H,19,20)
InChIKeyAJGKIDAIHUMTCA-UHFFFAOYSA-N
MW297.32 g/mol
LogP4.27
Rot. Bonds4

About N-(2-methylpropyl)-1-[2-methyl-5-(trifluoromethyl)phenyl]imidazol-2-amine

N-(2-methylpropyl)-1-[2-methyl-5-(trifluoromethyl)phenyl]imidazol-2-amine (PubChem CID 106575920) has the molecular formula C15H18F3N3 and a molecular weight of 297.32 g/mol. Its IUPAC name is N-(2-methylpropyl)-1-[2-methyl-5-(trifluoromethyl)phenyl]imidazol-2-amine.

Molecular Properties

Compound NameN-(2-methylpropyl)-1-[2-methyl-5-(trifluoromethyl)phenyl]imidazol-2-amine
PubChem CID106575920
Molecular FormulaC15H18F3N3
Molecular Weight297.32 g/mol
Exact Mass297.15
IUPAC NameN-(2-methylpropyl)-1-[2-methyl-5-(trifluoromethyl)phenyl]imidazol-2-amine
SMILESCc1ccc(C(F)(F)F)cc1-n1ccnc1NCC(C)C
InChIInChI=1S/C15H18F3N3/c1-10(2)9-20-14-19-6-7-21(14)13-8-12(15(16,17)18)5-4-11(13)3/h4-8,10H,9H2,1-3H3,(H,19,20)
InChIKeyAJGKIDAIHUMTCA-UHFFFAOYSA-N
XLogP4.27
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.32
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methylphenyl)-N-(2-methylpropyl)imidazol-2-amine
CID 106560588
1-(2-fluoro-3-methylphenyl)-N-(2-methylpropyl)imidazol-2-amine
CID 114254445
1-[2-chloro-5-(trifluoromethyl)phenyl]-N-ethylimidazol-2-amine
CID 106557968
1-(3-fluoro-2-methylphenyl)-N-(2-methylpropyl)imidazol-2-amine
CID 106564075
1-(2-chloro-3-methylphenyl)-N-(2-methylpropyl)imidazol-2-amine
CID 114250877
1-(4-methoxyphenyl)-N-(2-methylpropyl)imidazol-2-amine
CID 106554623
1-(2,5-dimethylphenyl)-N-methylimidazol-2-amine
CID 106558210
1-(5-bromo-2-methylphenyl)-N-butylimidazol-2-amine
CID 106562851
N-methyl-1-[4-(trifluoromethyl)phenyl]imidazol-2-amine
CID 106557098
N-(2-methylpropyl)-1-(4,4,4-trifluorobutyl)imidazol-2-amine
CID 106579152
(2S)-1-[2-methyl-5-(trifluoromethyl)anilino]propan-2-ol
CID 106932273
1-[2-methyl-5-(trifluoromethyl)anilino]propan-2-ol
CID 66479358

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-1-[2-methyl-5-(trifluoromethyl)phenyl]imidazol-2-amine?
The IUPAC name of N-(2-methylpropyl)-1-[2-methyl-5-(trifluoromethyl)phenyl]imidazol-2-amine (CID 106575920) is N-(2-methylpropyl)-1-[2-methyl-5-(trifluoromethyl)phenyl]imidazol-2-amine.
What is the SMILES notation for N-(2-methylpropyl)-1-[2-methyl-5-(trifluoromethyl)phenyl]imidazol-2-amine?
The canonical SMILES for N-(2-methylpropyl)-1-[2-methyl-5-(trifluoromethyl)phenyl]imidazol-2-amine is Cc1ccc(C(F)(F)F)cc1-n1ccnc1NCC(C)C.
What is the InChIKey of N-(2-methylpropyl)-1-[2-methyl-5-(trifluoromethyl)phenyl]imidazol-2-amine?
The InChIKey is AJGKIDAIHUMTCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18F3N3/c1-10(2)9-20-14-19-6-7-21(14)13-8-12(15(16,17)18)5-4-11(13)3/h4-8,10H,9H2,1-3H3,(H,19,20).
What are the key properties of N-(2-methylpropyl)-1-[2-methyl-5-(trifluoromethyl)phenyl]imidazol-2-amine?
N-(2-methylpropyl)-1-[2-methyl-5-(trifluoromethyl)phenyl]imidazol-2-amine has a molecular weight of 297.32 g/mol, XLogP of 4.27, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-1-[2-methyl-5-(trifluoromethyl)phenyl]imidazol-2-amine is sourced from PubChem (CID 106575920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).