1-(3-fluoro-4-phenylphenyl)-3-(4-methyl-3-pyridinyl)imidazolidin-2-one

C21H18FN3O — CID 174676000

IUPAC1-(3-fluoro-4-phenylphenyl)-3-(4-methyl-3-pyridinyl)imidazolidin-2-one
SMILESCc1ccncc1N1CCN(c2ccc(-c3ccccc3)c(F)c2)C1=O
InChIInChI=1S/C21H18FN3O/c1-15-9-10-23-14-20(15)25-12-11-24(21(25)26)17-7-8-18(19(22)13-17)16-5-3-2-4-6-16/h2-10,13-14H,11-12H2,1H3
InChIKeyWOSTWFYITDNTMA-UHFFFAOYSA-N
MW347.39 g/mol
LogP4.64
Rot. Bonds3

About 1-(3-fluoro-4-phenylphenyl)-3-(4-methyl-3-pyridinyl)imidazolidin-2-one

1-(3-fluoro-4-phenylphenyl)-3-(4-methyl-3-pyridinyl)imidazolidin-2-one (PubChem CID 174676000) has the molecular formula C21H18FN3O and a molecular weight of 347.39 g/mol. Its IUPAC name is 1-(3-fluoro-4-phenylphenyl)-3-(4-methyl-3-pyridinyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(3-fluoro-4-phenylphenyl)-3-(4-methyl-3-pyridinyl)imidazolidin-2-one
PubChem CID174676000
Molecular FormulaC21H18FN3O
Molecular Weight347.39 g/mol
Exact Mass347.14
IUPAC Name1-(3-fluoro-4-phenylphenyl)-3-(4-methyl-3-pyridinyl)imidazolidin-2-one
SMILESCc1ccncc1N1CCN(c2ccc(-c3ccccc3)c(F)c2)C1=O
InChIInChI=1S/C21H18FN3O/c1-15-9-10-23-14-20(15)25-12-11-24(21(25)26)17-7-8-18(19(22)13-17)16-5-3-2-4-6-16/h2-10,13-14H,11-12H2,1H3
InChIKeyWOSTWFYITDNTMA-UHFFFAOYSA-N
XLogP4.64
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.39
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-4-phenylphenyl)-3-(4-methyl-3-pyridinyl)imidazolidin-2-one?
The IUPAC name of 1-(3-fluoro-4-phenylphenyl)-3-(4-methyl-3-pyridinyl)imidazolidin-2-one (CID 174676000) is 1-(3-fluoro-4-phenylphenyl)-3-(4-methyl-3-pyridinyl)imidazolidin-2-one.
What is the SMILES notation for 1-(3-fluoro-4-phenylphenyl)-3-(4-methyl-3-pyridinyl)imidazolidin-2-one?
The canonical SMILES for 1-(3-fluoro-4-phenylphenyl)-3-(4-methyl-3-pyridinyl)imidazolidin-2-one is Cc1ccncc1N1CCN(c2ccc(-c3ccccc3)c(F)c2)C1=O.
What is the InChIKey of 1-(3-fluoro-4-phenylphenyl)-3-(4-methyl-3-pyridinyl)imidazolidin-2-one?
The InChIKey is WOSTWFYITDNTMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18FN3O/c1-15-9-10-23-14-20(15)25-12-11-24(21(25)26)17-7-8-18(19(22)13-17)16-5-3-2-4-6-16/h2-10,13-14H,11-12H2,1H3.
What are the key properties of 1-(3-fluoro-4-phenylphenyl)-3-(4-methyl-3-pyridinyl)imidazolidin-2-one?
1-(3-fluoro-4-phenylphenyl)-3-(4-methyl-3-pyridinyl)imidazolidin-2-one has a molecular weight of 347.39 g/mol, XLogP of 4.64, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-4-phenylphenyl)-3-(4-methyl-3-pyridinyl)imidazolidin-2-one is sourced from PubChem (CID 174676000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).