4-(fluoromethyl)-1,3-dimethylimidazolidin-2-one

C6H11FN2O — CID 67255737

IUPAC4-(fluoromethyl)-1,3-dimethylimidazolidin-2-one
SMILESCN1CC(CF)N(C)C1=O
InChIInChI=1S/C6H11FN2O/c1-8-4-5(3-7)9(2)6(8)10/h5H,3-4H2,1-2H3
InChIKeyPXOOFEXZZJWERN-UHFFFAOYSA-N
MW146.16 g/mol
LogP0.32
Rot. Bonds1

About 4-(fluoromethyl)-1,3-dimethylimidazolidin-2-one

4-(fluoromethyl)-1,3-dimethylimidazolidin-2-one (PubChem CID 67255737) has the molecular formula C6H11FN2O and a molecular weight of 146.16 g/mol. Its IUPAC name is 4-(fluoromethyl)-1,3-dimethylimidazolidin-2-one.

Molecular Properties

Compound Name4-(fluoromethyl)-1,3-dimethylimidazolidin-2-one
PubChem CID67255737
Molecular FormulaC6H11FN2O
Molecular Weight146.16 g/mol
Exact Mass146.09
IUPAC Name4-(fluoromethyl)-1,3-dimethylimidazolidin-2-one
SMILESCN1CC(CF)N(C)C1=O
InChIInChI=1S/C6H11FN2O/c1-8-4-5(3-7)9(2)6(8)10/h5H,3-4H2,1-2H3
InChIKeyPXOOFEXZZJWERN-UHFFFAOYSA-N
XLogP0.32
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.16
LogP ≤ 50.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-Imidazolidinone, 1,3,4-trimethyl-
CID 10313143
1,3-Diisopropylimidazolidin-2-one
CID 22024133
1-Methyl-3-propan-2-ylimidazolidin-2-one
CID 14177967
1-Butan-2-yl-3-methylimidazolidin-2-one
CID 101464581
4-(2,2-Difluoroethyl)-1,3-dimethylimidazolidin-2-one
CID 67253577
4-(Fluoromethyl)-1-methylimidazolidin-2-one
CID 67254784
4-(2-Fluoroethyl)-1-methylimidazolidin-2-one
CID 67255418
4-(2-Fluoroethyl)-1,3-dimethylimidazolidin-2-one
CID 67255469
4-(Difluoromethyl)-1,3-dimethylimidazolidin-2-one
CID 67256131
5-(2-Fluoroethyl)-1-methylimidazolidin-2-one
CID 67256724
5-(Fluoromethyl)-1-methylimidazolidin-2-one
CID 67260497
4-(2-Fluoroethynyl)-1,3-dimethylimidazolidin-2-one
CID 89446167

Frequently Asked Questions

What is the IUPAC name of 4-(fluoromethyl)-1,3-dimethylimidazolidin-2-one?
The IUPAC name of 4-(fluoromethyl)-1,3-dimethylimidazolidin-2-one (CID 67255737) is 4-(fluoromethyl)-1,3-dimethylimidazolidin-2-one.
What is the SMILES notation for 4-(fluoromethyl)-1,3-dimethylimidazolidin-2-one?
The canonical SMILES for 4-(fluoromethyl)-1,3-dimethylimidazolidin-2-one is CN1CC(CF)N(C)C1=O.
What is the InChIKey of 4-(fluoromethyl)-1,3-dimethylimidazolidin-2-one?
The InChIKey is PXOOFEXZZJWERN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11FN2O/c1-8-4-5(3-7)9(2)6(8)10/h5H,3-4H2,1-2H3.
What are the key properties of 4-(fluoromethyl)-1,3-dimethylimidazolidin-2-one?
4-(fluoromethyl)-1,3-dimethylimidazolidin-2-one has a molecular weight of 146.16 g/mol, XLogP of 0.32, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(fluoromethyl)-1,3-dimethylimidazolidin-2-one is sourced from PubChem (CID 67255737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).