2-(3,4-difluorophenyl)-3-[2-[ethyl(methyl)amino]ethyl]-5-methylimidazolidin-4-one

C15H21F2N3O — CID 83253778

IUPAC2-(3,4-difluorophenyl)-3-[2-[ethyl(methyl)amino]ethyl]-5-methylimidazolidin-4-one
SMILESCCN(C)CCN1C(=O)C(C)NC1c1ccc(F)c(F)c1
InChIInChI=1S/C15H21F2N3O/c1-4-19(3)7-8-20-14(18-10(2)15(20)21)11-5-6-12(16)13(17)9-11/h5-6,9-10,14,18H,4,7-8H2,1-3H3
InChIKeyXGJPTCAOLQXRSE-UHFFFAOYSA-N
MW297.35 g/mol
LogP1.74
Rot. Bonds5

About 2-(3,4-difluorophenyl)-3-[2-[ethyl(methyl)amino]ethyl]-5-methylimidazolidin-4-one

2-(3,4-difluorophenyl)-3-[2-[ethyl(methyl)amino]ethyl]-5-methylimidazolidin-4-one (PubChem CID 83253778) has the molecular formula C15H21F2N3O and a molecular weight of 297.35 g/mol. Its IUPAC name is 2-(3,4-difluorophenyl)-3-[2-[ethyl(methyl)amino]ethyl]-5-methylimidazolidin-4-one.

Molecular Properties

Compound Name2-(3,4-difluorophenyl)-3-[2-[ethyl(methyl)amino]ethyl]-5-methylimidazolidin-4-one
PubChem CID83253778
Molecular FormulaC15H21F2N3O
Molecular Weight297.35 g/mol
Exact Mass297.17
IUPAC Name2-(3,4-difluorophenyl)-3-[2-[ethyl(methyl)amino]ethyl]-5-methylimidazolidin-4-one
SMILESCCN(C)CCN1C(=O)C(C)NC1c1ccc(F)c(F)c1
InChIInChI=1S/C15H21F2N3O/c1-4-19(3)7-8-20-14(18-10(2)15(20)21)11-5-6-12(16)13(17)9-11/h5-6,9-10,14,18H,4,7-8H2,1-3H3
InChIKeyXGJPTCAOLQXRSE-UHFFFAOYSA-N
XLogP1.74
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.35
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,4-difluorophenyl)-3-[2-(dimethylamino)ethyl]-5-methylimidazolidin-4-one
CID 83250579
3-[2-[ethyl(methyl)amino]ethyl]-2-(4-fluorophenyl)-5-methylimidazolidin-4-one
CID 83255113
2-(3,4-difluorophenyl)-3-(3-ethoxypropyl)-5-methylimidazolidin-4-one
CID 83233543
3-(2-cyclopropylethyl)-2-(3,4-difluorophenyl)-5-methylimidazolidin-4-one
CID 83259017
3-[2-(dimethylamino)ethyl]-2-(4-fluorophenyl)-5-methylimidazolidin-4-one
CID 83250403
2-(3,4-difluorophenyl)-5-ethyl-3-propylimidazolidin-4-one
CID 83241892
2-(4-fluorophenyl)-5-methyl-3-propylimidazolidin-4-one
CID 115282121
2-(4-chlorophenyl)-3-[2-[cyclopropyl(methyl)amino]ethyl]-5-methylimidazolidin-4-one
CID 83248992
3-[2-(diethylamino)ethyl]-5-methyl-2-phenylimidazolidin-4-one
CID 83240103
3-[2-(dimethylamino)ethyl]-5-methyl-2-(3-methylphenyl)imidazolidin-4-one
CID 83250661
3-[3-(dimethylamino)propyl]-2-(3-fluorophenyl)-5-methylimidazolidin-4-one
CID 83250449
2-(3,4-difluorophenyl)-5-methyl-3-(oxolan-2-ylmethyl)imidazolidin-4-one
CID 83245722

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-difluorophenyl)-3-[2-[ethyl(methyl)amino]ethyl]-5-methylimidazolidin-4-one?
The IUPAC name of 2-(3,4-difluorophenyl)-3-[2-[ethyl(methyl)amino]ethyl]-5-methylimidazolidin-4-one (CID 83253778) is 2-(3,4-difluorophenyl)-3-[2-[ethyl(methyl)amino]ethyl]-5-methylimidazolidin-4-one.
What is the SMILES notation for 2-(3,4-difluorophenyl)-3-[2-[ethyl(methyl)amino]ethyl]-5-methylimidazolidin-4-one?
The canonical SMILES for 2-(3,4-difluorophenyl)-3-[2-[ethyl(methyl)amino]ethyl]-5-methylimidazolidin-4-one is CCN(C)CCN1C(=O)C(C)NC1c1ccc(F)c(F)c1.
What is the InChIKey of 2-(3,4-difluorophenyl)-3-[2-[ethyl(methyl)amino]ethyl]-5-methylimidazolidin-4-one?
The InChIKey is XGJPTCAOLQXRSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21F2N3O/c1-4-19(3)7-8-20-14(18-10(2)15(20)21)11-5-6-12(16)13(17)9-11/h5-6,9-10,14,18H,4,7-8H2,1-3H3.
What are the key properties of 2-(3,4-difluorophenyl)-3-[2-[ethyl(methyl)amino]ethyl]-5-methylimidazolidin-4-one?
2-(3,4-difluorophenyl)-3-[2-[ethyl(methyl)amino]ethyl]-5-methylimidazolidin-4-one has a molecular weight of 297.35 g/mol, XLogP of 1.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-difluorophenyl)-3-[2-[ethyl(methyl)amino]ethyl]-5-methylimidazolidin-4-one is sourced from PubChem (CID 83253778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).