2,4-dichloro-5-(trifluoromethyl)-1H-imidazole

C4HCl2F3N2 — CID 609238

IUPAC2,4-dichloro-5-(trifluoromethyl)-1H-imidazole
SMILESFC(F)(F)c1[nH]c(Cl)nc1Cl
InChIInChI=1S/C4HCl2F3N2/c5-2-1(4(7,8)9)10-3(6)11-2/h(H,10,11)
InChIKeyJQINKLVERMSPHS-UHFFFAOYSA-N
MW204.97 g/mol
LogP2.74
Rot. Bonds

About 2,4-dichloro-5-(trifluoromethyl)-1H-imidazole

2,4-dichloro-5-(trifluoromethyl)-1H-imidazole (PubChem CID 609238) has the molecular formula C4HCl2F3N2 and a molecular weight of 204.97 g/mol. Its IUPAC name is 2,4-dichloro-5-(trifluoromethyl)-1H-imidazole.

Molecular Properties

Compound Name2,4-dichloro-5-(trifluoromethyl)-1H-imidazole
PubChem CID609238
Molecular FormulaC4HCl2F3N2
Molecular Weight204.97 g/mol
Exact Mass203.95
IUPAC Name2,4-dichloro-5-(trifluoromethyl)-1H-imidazole
SMILESFC(F)(F)c1[nH]c(Cl)nc1Cl
InChIInChI=1S/C4HCl2F3N2/c5-2-1(4(7,8)9)10-3(6)11-2/h(H,10,11)
InChIKeyJQINKLVERMSPHS-UHFFFAOYSA-N
XLogP2.74
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.97
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,4,5-trichloro-1H-imidazole
CID 24357
5-(trifluoromethyl)-1H-imidazole-2,4-diamine
CID 69332688
2-chloro-4,6-bis(trifluoromethyl)-1H-benzimidazole
CID 11529388
2-[3-chloro-5-(trifluoromethyl)-1H-pyrazol-4-yl]ethanamine
CID 83886119
4,6-dichloro-5-methyl-2-(trifluoromethyl)pyrimidine
CID 58035237
5-(trifluoromethyl)-1H-imidazole-2,4-dicarbonitrile
CID 162539224
6-chloro-3-(trifluoromethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 115042324
1-[2-amino-5-(trifluoromethyl)-1H-imidazol-4-yl]-2,2,2-trifluoroethanone
CID 50999010
5-chloro-3-iodo-6-(trifluoromethyl)-1H-pyridin-2-one
CID 67121042
4-chloro-6-fluoro-5-(trifluoromethyl)pyrimidine
CID 118799997
4-bromo-2-[2-chloro-6-fluoro-4-(1,1,2,2,2-pentafluoroethyl)phenyl]-5-(trifluoromethyl)-1H-imidazole
CID 20551778
3-bromo-2-chloro-5-(trifluoromethyl)pyrazine
CID 130116239

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-5-(trifluoromethyl)-1H-imidazole?
The IUPAC name of 2,4-dichloro-5-(trifluoromethyl)-1H-imidazole (CID 609238) is 2,4-dichloro-5-(trifluoromethyl)-1H-imidazole.
What is the SMILES notation for 2,4-dichloro-5-(trifluoromethyl)-1H-imidazole?
The canonical SMILES for 2,4-dichloro-5-(trifluoromethyl)-1H-imidazole is FC(F)(F)c1[nH]c(Cl)nc1Cl.
What is the InChIKey of 2,4-dichloro-5-(trifluoromethyl)-1H-imidazole?
The InChIKey is JQINKLVERMSPHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4HCl2F3N2/c5-2-1(4(7,8)9)10-3(6)11-2/h(H,10,11).
What are the key properties of 2,4-dichloro-5-(trifluoromethyl)-1H-imidazole?
2,4-dichloro-5-(trifluoromethyl)-1H-imidazole has a molecular weight of 204.97 g/mol, XLogP of 2.74, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-5-(trifluoromethyl)-1H-imidazole is sourced from PubChem (CID 609238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).