4-(3-fluorophenyl)-5-propan-2-yl-1,3-dihydroimidazol-2-one

C12H13FN2O — CID 105475415

IUPAC4-(3-fluorophenyl)-5-propan-2-yl-1,3-dihydroimidazol-2-one
SMILESCC(C)c1[nH]c(=O)[nH]c1-c1cccc(F)c1
InChIInChI=1S/C12H13FN2O/c1-7(2)10-11(15-12(16)14-10)8-4-3-5-9(13)6-8/h3-7H,1-2H3,(H2,14,15,16)
InChIKeyMCSXGEFRNADKHR-UHFFFAOYSA-N
MW220.25 g/mol
LogP2.63
Rot. Bonds2

About 4-(3-fluorophenyl)-5-propan-2-yl-1,3-dihydroimidazol-2-one

4-(3-fluorophenyl)-5-propan-2-yl-1,3-dihydroimidazol-2-one (PubChem CID 105475415) has the molecular formula C12H13FN2O and a molecular weight of 220.25 g/mol. Its IUPAC name is 4-(3-fluorophenyl)-5-propan-2-yl-1,3-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-(3-fluorophenyl)-5-propan-2-yl-1,3-dihydroimidazol-2-one
PubChem CID105475415
Molecular FormulaC12H13FN2O
Molecular Weight220.25 g/mol
Exact Mass220.10
IUPAC Name4-(3-fluorophenyl)-5-propan-2-yl-1,3-dihydroimidazol-2-one
SMILESCC(C)c1[nH]c(=O)[nH]c1-c1cccc(F)c1
InChIInChI=1S/C12H13FN2O/c1-7(2)10-11(15-12(16)14-10)8-4-3-5-9(13)6-8/h3-7H,1-2H3,(H2,14,15,16)
InChIKeyMCSXGEFRNADKHR-UHFFFAOYSA-N
XLogP2.63
TPSA48.65 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.25
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

4-(3-fluorophenyl)-5-propan-2-yl-3H-1,3-thiazol-2-one
CID 105499043
4-(3-fluorophenyl)-5-propan-2-yl-1H-pyrazol-3-amine
CID 43157693
4-(3-fluorophenyl)-5-methyl-3H-1,3-thiazol-2-one
CID 112694812
2-(3-fluorophenyl)-5-propan-2-yl-1H-imidazole-4-carboxylic acid
CID 43445116
5-ethyl-4-(3-fluorophenyl)-3H-1,3-oxazol-2-one
CID 105459937
6-(3-fluorophenyl)-5-methyl-2-oxo-1H-pyridine-3-carboxylic acid
CID 114872883
4-(3-fluorophenyl)-2-(trifluoromethyl)-1H-pyrimidin-6-one
CID 137000859
6-(3-fluorophenyl)-2-propan-2-yl-1H-pyrimidine-4-thione
CID 106515384
4-ethyl-5-(3-fluorophenyl)-1H-pyrazole
CID 143699505
2-[3-(3-fluorophenyl)-1H-pyrazol-5-yl]propanoic acid
CID 105494091
4-chloro-6-(3-fluorophenyl)-2-propan-2-ylpyrimidine
CID 80952962
6-(3-fluorophenyl)-1,3-oxazine-2,4-dione
CID 13370936

Frequently Asked Questions

What is the IUPAC name of 4-(3-fluorophenyl)-5-propan-2-yl-1,3-dihydroimidazol-2-one?
The IUPAC name of 4-(3-fluorophenyl)-5-propan-2-yl-1,3-dihydroimidazol-2-one (CID 105475415) is 4-(3-fluorophenyl)-5-propan-2-yl-1,3-dihydroimidazol-2-one.
What is the SMILES notation for 4-(3-fluorophenyl)-5-propan-2-yl-1,3-dihydroimidazol-2-one?
The canonical SMILES for 4-(3-fluorophenyl)-5-propan-2-yl-1,3-dihydroimidazol-2-one is CC(C)c1[nH]c(=O)[nH]c1-c1cccc(F)c1.
What is the InChIKey of 4-(3-fluorophenyl)-5-propan-2-yl-1,3-dihydroimidazol-2-one?
The InChIKey is MCSXGEFRNADKHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13FN2O/c1-7(2)10-11(15-12(16)14-10)8-4-3-5-9(13)6-8/h3-7H,1-2H3,(H2,14,15,16).
What are the key properties of 4-(3-fluorophenyl)-5-propan-2-yl-1,3-dihydroimidazol-2-one?
4-(3-fluorophenyl)-5-propan-2-yl-1,3-dihydroimidazol-2-one has a molecular weight of 220.25 g/mol, XLogP of 2.63, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluorophenyl)-5-propan-2-yl-1,3-dihydroimidazol-2-one is sourced from PubChem (CID 105475415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).