4-(2-fluoropropan-2-yl)-5-methyl-1,3-dihydroimidazol-2-one

C7H11FN2O — CID 84763989

IUPAC4-(2-fluoropropan-2-yl)-5-methyl-1,3-dihydroimidazol-2-one
SMILESCc1[nH]c(=O)[nH]c1C(C)(C)F
InChIInChI=1S/C7H11FN2O/c1-4-5(7(2,3)8)10-6(11)9-4/h1-3H3,(H2,9,10,11)
InChIKeyPOSJXKWGHZOGAG-UHFFFAOYSA-N
MW158.18 g/mol
LogP1.22
Rot. Bonds1

About 4-(2-fluoropropan-2-yl)-5-methyl-1,3-dihydroimidazol-2-one

4-(2-fluoropropan-2-yl)-5-methyl-1,3-dihydroimidazol-2-one (PubChem CID 84763989) has the molecular formula C7H11FN2O and a molecular weight of 158.18 g/mol. Its IUPAC name is 4-(2-fluoropropan-2-yl)-5-methyl-1,3-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-(2-fluoropropan-2-yl)-5-methyl-1,3-dihydroimidazol-2-one
PubChem CID84763989
Molecular FormulaC7H11FN2O
Molecular Weight158.18 g/mol
Exact Mass158.09
IUPAC Name4-(2-fluoropropan-2-yl)-5-methyl-1,3-dihydroimidazol-2-one
SMILESCc1[nH]c(=O)[nH]c1C(C)(C)F
InChIInChI=1S/C7H11FN2O/c1-4-5(7(2,3)8)10-6(11)9-4/h1-3H3,(H2,9,10,11)
InChIKeyPOSJXKWGHZOGAG-UHFFFAOYSA-N
XLogP1.22
TPSA48.65 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.18
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 4-(2-fluoropropan-2-yl)-5-methyl-1,3-dihydroimidazol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoropropan-2-yl)-5-methyl-1,3-dihydroimidazol-2-one?
The IUPAC name of 4-(2-fluoropropan-2-yl)-5-methyl-1,3-dihydroimidazol-2-one (CID 84763989) is 4-(2-fluoropropan-2-yl)-5-methyl-1,3-dihydroimidazol-2-one.
What is the SMILES notation for 4-(2-fluoropropan-2-yl)-5-methyl-1,3-dihydroimidazol-2-one?
The canonical SMILES for 4-(2-fluoropropan-2-yl)-5-methyl-1,3-dihydroimidazol-2-one is Cc1[nH]c(=O)[nH]c1C(C)(C)F.
What is the InChIKey of 4-(2-fluoropropan-2-yl)-5-methyl-1,3-dihydroimidazol-2-one?
The InChIKey is POSJXKWGHZOGAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11FN2O/c1-4-5(7(2,3)8)10-6(11)9-4/h1-3H3,(H2,9,10,11).
What are the key properties of 4-(2-fluoropropan-2-yl)-5-methyl-1,3-dihydroimidazol-2-one?
4-(2-fluoropropan-2-yl)-5-methyl-1,3-dihydroimidazol-2-one has a molecular weight of 158.18 g/mol, XLogP of 1.22, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoropropan-2-yl)-5-methyl-1,3-dihydroimidazol-2-one is sourced from PubChem (CID 84763989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).