N-cyclopropyl-1-[4-(trifluoromethoxy)phenyl]imidazol-2-amine

C13H12F3N3O — CID 106557401

IUPACN-cyclopropyl-1-[4-(trifluoromethoxy)phenyl]imidazol-2-amine
SMILESFC(F)(F)Oc1ccc(-n2ccnc2NC2CC2)cc1
InChIInChI=1S/C13H12F3N3O/c14-13(15,16)20-11-5-3-10(4-6-11)19-8-7-17-12(19)18-9-1-2-9/h3-9H,1-2H2,(H,17,18)
InChIKeyCGGLBGAKIOTAEZ-UHFFFAOYSA-N
MW283.25 g/mol
LogP3.35
Rot. Bonds4

About N-cyclopropyl-1-[4-(trifluoromethoxy)phenyl]imidazol-2-amine

N-cyclopropyl-1-[4-(trifluoromethoxy)phenyl]imidazol-2-amine (PubChem CID 106557401) has the molecular formula C13H12F3N3O and a molecular weight of 283.25 g/mol. Its IUPAC name is N-cyclopropyl-1-[4-(trifluoromethoxy)phenyl]imidazol-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-1-[4-(trifluoromethoxy)phenyl]imidazol-2-amine
PubChem CID106557401
Molecular FormulaC13H12F3N3O
Molecular Weight283.25 g/mol
Exact Mass283.09
IUPAC NameN-cyclopropyl-1-[4-(trifluoromethoxy)phenyl]imidazol-2-amine
SMILESFC(F)(F)Oc1ccc(-n2ccnc2NC2CC2)cc1
InChIInChI=1S/C13H12F3N3O/c14-13(15,16)20-11-5-3-10(4-6-11)19-8-7-17-12(19)18-9-1-2-9/h3-9H,1-2H2,(H,17,18)
InChIKeyCGGLBGAKIOTAEZ-UHFFFAOYSA-N
XLogP3.35
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.25
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-1-(4-ethoxyphenyl)imidazol-2-amine
CID 106555769
1-(4-butylphenyl)-N-cyclopropylimidazol-2-amine
CID 106561505
1-cyclopropyl-N-[4-(trifluoromethoxy)phenyl]imidazol-2-amine
CID 106557392
N-(1-phenylimidazol-2-yl)piperidin-4-amine
CID 115044800
1-(3-bromo-4-chlorophenyl)-N-cyclopropylimidazol-2-amine
CID 106576642
1-(3-bromo-4-fluorophenyl)-N-cyclopentylimidazol-2-amine
CID 106581538
N-cyclopentyl-1-(3-ethoxyphenyl)imidazol-2-amine
CID 106566737
N-cyclohexyl-1-(3,4,5-trifluorophenyl)imidazol-2-amine
CID 106570813
N-cyclohexyl-1-(4-methoxy-3-methylphenyl)imidazol-2-amine
CID 106564117
1-(4-chloro-3-methoxyphenyl)-N-cyclohexylimidazol-2-amine
CID 107623823
N-cyclopentyl-1-(3-ethylphenyl)imidazol-2-amine
CID 106559803
N-cyclopentyl-1-(3-iodophenyl)imidazol-2-amine
CID 106554214

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-[4-(trifluoromethoxy)phenyl]imidazol-2-amine?
The IUPAC name of N-cyclopropyl-1-[4-(trifluoromethoxy)phenyl]imidazol-2-amine (CID 106557401) is N-cyclopropyl-1-[4-(trifluoromethoxy)phenyl]imidazol-2-amine.
What is the SMILES notation for N-cyclopropyl-1-[4-(trifluoromethoxy)phenyl]imidazol-2-amine?
The canonical SMILES for N-cyclopropyl-1-[4-(trifluoromethoxy)phenyl]imidazol-2-amine is FC(F)(F)Oc1ccc(-n2ccnc2NC2CC2)cc1.
What is the InChIKey of N-cyclopropyl-1-[4-(trifluoromethoxy)phenyl]imidazol-2-amine?
The InChIKey is CGGLBGAKIOTAEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12F3N3O/c14-13(15,16)20-11-5-3-10(4-6-11)19-8-7-17-12(19)18-9-1-2-9/h3-9H,1-2H2,(H,17,18).
What are the key properties of N-cyclopropyl-1-[4-(trifluoromethoxy)phenyl]imidazol-2-amine?
N-cyclopropyl-1-[4-(trifluoromethoxy)phenyl]imidazol-2-amine has a molecular weight of 283.25 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-[4-(trifluoromethoxy)phenyl]imidazol-2-amine is sourced from PubChem (CID 106557401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).