1-(2-fluoroethyl)-4-(fluoromethyl)-4,5-dihydroimidazole

C6H10F2N2 — CID 173378803

IUPAC1-(2-fluoroethyl)-4-(fluoromethyl)-4,5-dihydroimidazole
SMILESFCCN1C=NC(CF)C1
InChIInChI=1S/C6H10F2N2/c7-1-2-10-4-6(3-8)9-5-10/h5-6H,1-4H2
InChIKeyFWGMSAPQRCPFHV-UHFFFAOYSA-N
MW148.16 g/mol
LogP0.64
Rot. Bonds3

About 1-(2-fluoroethyl)-4-(fluoromethyl)-4,5-dihydroimidazole

1-(2-fluoroethyl)-4-(fluoromethyl)-4,5-dihydroimidazole (PubChem CID 173378803) has the molecular formula C6H10F2N2 and a molecular weight of 148.16 g/mol. Its IUPAC name is 1-(2-fluoroethyl)-4-(fluoromethyl)-4,5-dihydroimidazole.

Molecular Properties

Compound Name1-(2-fluoroethyl)-4-(fluoromethyl)-4,5-dihydroimidazole
PubChem CID173378803
Molecular FormulaC6H10F2N2
Molecular Weight148.16 g/mol
Exact Mass148.08
IUPAC Name1-(2-fluoroethyl)-4-(fluoromethyl)-4,5-dihydroimidazole
SMILESFCCN1C=NC(CF)C1
InChIInChI=1S/C6H10F2N2/c7-1-2-10-4-6(3-8)9-5-10/h5-6H,1-4H2
InChIKeyFWGMSAPQRCPFHV-UHFFFAOYSA-N
XLogP0.64
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.16
LogP ≤ 50.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,3,4,5-Tetramethyl-4,5-dihydroimidazol-1-ium
CID 91506433
1-Methyl-4-(trifluoromethyl)-4,5-dihydroimidazole
CID 123358722
1-Methyl-5-(trifluoromethyl)-4,5-dihydroimidazole
CID 123407947
1-(2-Fluoroethyl)-4,5-dimethyl-4,5-dihydroimidazole
CID 155110830
1-(3,3-Difluorocyclobutyl)-4,5-dihydroimidazole
CID 167316525
1-(Difluoromethyl)-4-(fluoromethyl)-4,5-dihydroimidazole
CID 173378772
4-Ethyl-1-(2,2,2-trifluoroethyl)-4,5-dihydroimidazole
CID 173378802
1-(Difluoromethyl)-4-ethyl-4,5-dihydroimidazole
CID 173378807
1-(2-Fluoroethyl)-4-methyl-4,5-dihydroimidazole
CID 173378813
4-(Difluoromethyl)-1-methyl-4,5-dihydroimidazole
CID 173378835
1,4-Bis(fluoromethyl)-4,5-dihydroimidazole
CID 173378840
1-(2,2,2-Trifluoroethyl)-4,5-dihydroimidazole-4-carbonitrile
CID 173378870

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoroethyl)-4-(fluoromethyl)-4,5-dihydroimidazole?
The IUPAC name of 1-(2-fluoroethyl)-4-(fluoromethyl)-4,5-dihydroimidazole (CID 173378803) is 1-(2-fluoroethyl)-4-(fluoromethyl)-4,5-dihydroimidazole.
What is the SMILES notation for 1-(2-fluoroethyl)-4-(fluoromethyl)-4,5-dihydroimidazole?
The canonical SMILES for 1-(2-fluoroethyl)-4-(fluoromethyl)-4,5-dihydroimidazole is FCCN1C=NC(CF)C1.
What is the InChIKey of 1-(2-fluoroethyl)-4-(fluoromethyl)-4,5-dihydroimidazole?
The InChIKey is FWGMSAPQRCPFHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F2N2/c7-1-2-10-4-6(3-8)9-5-10/h5-6H,1-4H2.
What are the key properties of 1-(2-fluoroethyl)-4-(fluoromethyl)-4,5-dihydroimidazole?
1-(2-fluoroethyl)-4-(fluoromethyl)-4,5-dihydroimidazole has a molecular weight of 148.16 g/mol, XLogP of 0.64, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoroethyl)-4-(fluoromethyl)-4,5-dihydroimidazole is sourced from PubChem (CID 173378803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).