N-[1-(4-fluorophenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide

C15H20FN3O2 — CID 134797135

IUPACN-[1-(4-fluorophenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide
SMILESCC(NC(=O)C1CN(C(C)C)C(=O)N1)c1ccc(F)cc1
InChIInChI=1S/C15H20FN3O2/c1-9(2)19-8-13(18-15(19)21)14(20)17-10(3)11-4-6-12(16)7-5-11/h4-7,9-10,13H,8H2,1-3H3,(H,17,20)(H,18,21)
InChIKeyDNRCCXSQRIDELU-UHFFFAOYSA-N
MW293.34 g/mol
LogP1.81
Rot. Bonds4

About N-[1-(4-fluorophenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide

N-[1-(4-fluorophenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide (PubChem CID 134797135) has the molecular formula C15H20FN3O2 and a molecular weight of 293.34 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide
PubChem CID134797135
Molecular FormulaC15H20FN3O2
Molecular Weight293.34 g/mol
Exact Mass293.15
IUPAC NameN-[1-(4-fluorophenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide
SMILESCC(NC(=O)C1CN(C(C)C)C(=O)N1)c1ccc(F)cc1
InChIInChI=1S/C15H20FN3O2/c1-9(2)19-8-13(18-15(19)21)14(20)17-10(3)11-4-6-12(16)7-5-11/h4-7,9-10,13H,8H2,1-3H3,(H,17,20)(H,18,21)
InChIKeyDNRCCXSQRIDELU-UHFFFAOYSA-N
XLogP1.81
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.34
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide?
The IUPAC name of N-[1-(4-fluorophenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide (CID 134797135) is N-[1-(4-fluorophenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide.
What is the SMILES notation for N-[1-(4-fluorophenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide?
The canonical SMILES for N-[1-(4-fluorophenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide is CC(NC(=O)C1CN(C(C)C)C(=O)N1)c1ccc(F)cc1.
What is the InChIKey of N-[1-(4-fluorophenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide?
The InChIKey is DNRCCXSQRIDELU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FN3O2/c1-9(2)19-8-13(18-15(19)21)14(20)17-10(3)11-4-6-12(16)7-5-11/h4-7,9-10,13H,8H2,1-3H3,(H,17,20)(H,18,21).
What are the key properties of N-[1-(4-fluorophenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide?
N-[1-(4-fluorophenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide has a molecular weight of 293.34 g/mol, XLogP of 1.81, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)ethyl]-2-oxo-1-propan-2-ylimidazolidine-4-carboxamide is sourced from PubChem (CID 134797135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).