1-(2-methylpropyl)-N-[3-(trifluoromethyl)phenyl]imidazol-2-amine

C14H16F3N3 — CID 106556215

IUPAC1-(2-methylpropyl)-N-[3-(trifluoromethyl)phenyl]imidazol-2-amine
SMILESCC(C)Cn1ccnc1Nc1cccc(C(F)(F)F)c1
InChIInChI=1S/C14H16F3N3/c1-10(2)9-20-7-6-18-13(20)19-12-5-3-4-11(8-12)14(15,16)17/h3-8,10H,9H2,1-2H3,(H,18,19)
InChIKeyASTMRZNMIDSOPP-UHFFFAOYSA-N
MW283.30 g/mol
LogP4.30
Rot. Bonds4

About 1-(2-methylpropyl)-N-[3-(trifluoromethyl)phenyl]imidazol-2-amine

1-(2-methylpropyl)-N-[3-(trifluoromethyl)phenyl]imidazol-2-amine (PubChem CID 106556215) has the molecular formula C14H16F3N3 and a molecular weight of 283.30 g/mol. Its IUPAC name is 1-(2-methylpropyl)-N-[3-(trifluoromethyl)phenyl]imidazol-2-amine.

Molecular Properties

Compound Name1-(2-methylpropyl)-N-[3-(trifluoromethyl)phenyl]imidazol-2-amine
PubChem CID106556215
Molecular FormulaC14H16F3N3
Molecular Weight283.30 g/mol
Exact Mass283.13
IUPAC Name1-(2-methylpropyl)-N-[3-(trifluoromethyl)phenyl]imidazol-2-amine
SMILESCC(C)Cn1ccnc1Nc1cccc(C(F)(F)F)c1
InChIInChI=1S/C14H16F3N3/c1-10(2)9-20-7-6-18-13(20)19-12-5-3-4-11(8-12)14(15,16)17/h3-8,10H,9H2,1-2H3,(H,18,19)
InChIKeyASTMRZNMIDSOPP-UHFFFAOYSA-N
XLogP4.30
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.30
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxypropyl)-N-phenylimidazol-2-amine
CID 106583404
N-(4-chloro-2-fluorophenyl)-1-(2-methylpropyl)imidazol-2-amine
CID 106568967
1-propan-2-yl-N-[3-(trifluoromethyl)phenyl]benzimidazol-2-amine
CID 924018
N-(2,4-dichlorophenyl)-1-(2-methylpropyl)imidazol-2-amine
CID 106556363
1-ethyl-N-[4-fluoro-3-(trifluoromethyl)phenyl]imidazol-2-amine
CID 106563760
2-N,4-N-bis[3-(trifluoromethyl)phenyl]pyridine-2,4-diamine
CID 11696916
1-N-methyl-4-N-[3-(trifluoromethyl)phenyl]benzene-1,4-diamine
CID 117027255
5-(2-methylpropyl)-N-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 107153737
N-phenyl-1-(2-piperidin-1-ylpropyl)imidazol-2-amine
CID 106567928
N-[(3-bromophenyl)methyl]-1-(2-methylpropyl)imidazol-2-amine
CID 106569127
N-(2-methylpropyl)-2-[3-(trifluoromethyl)anilino]pyrimidine-4-carboxamide
CID 109297024
1-[[3-(trifluoromethyl)phenyl]methyl]imidazol-2-amine
CID 60861273

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpropyl)-N-[3-(trifluoromethyl)phenyl]imidazol-2-amine?
The IUPAC name of 1-(2-methylpropyl)-N-[3-(trifluoromethyl)phenyl]imidazol-2-amine (CID 106556215) is 1-(2-methylpropyl)-N-[3-(trifluoromethyl)phenyl]imidazol-2-amine.
What is the SMILES notation for 1-(2-methylpropyl)-N-[3-(trifluoromethyl)phenyl]imidazol-2-amine?
The canonical SMILES for 1-(2-methylpropyl)-N-[3-(trifluoromethyl)phenyl]imidazol-2-amine is CC(C)Cn1ccnc1Nc1cccc(C(F)(F)F)c1.
What is the InChIKey of 1-(2-methylpropyl)-N-[3-(trifluoromethyl)phenyl]imidazol-2-amine?
The InChIKey is ASTMRZNMIDSOPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16F3N3/c1-10(2)9-20-7-6-18-13(20)19-12-5-3-4-11(8-12)14(15,16)17/h3-8,10H,9H2,1-2H3,(H,18,19).
What are the key properties of 1-(2-methylpropyl)-N-[3-(trifluoromethyl)phenyl]imidazol-2-amine?
1-(2-methylpropyl)-N-[3-(trifluoromethyl)phenyl]imidazol-2-amine has a molecular weight of 283.30 g/mol, XLogP of 4.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpropyl)-N-[3-(trifluoromethyl)phenyl]imidazol-2-amine is sourced from PubChem (CID 106556215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).