1-[3-(3-methylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one

C15H19N3O3 — CID 51087000

IUPAC1-[3-(3-methylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one
SMILESCC1COCCN1C(=O)c1cccc(N2CCNC2=O)c1
InChIInChI=1S/C15H19N3O3/c1-11-10-21-8-7-17(11)14(19)12-3-2-4-13(9-12)18-6-5-16-15(18)20/h2-4,9,11H,5-8,10H2,1H3,(H,16,20)
InChIKeyBMFOPGLQVKKWJS-UHFFFAOYSA-N
MW289.33 g/mol
LogP1.08
Rot. Bonds2

About 1-[3-(3-methylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one

1-[3-(3-methylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one (PubChem CID 51087000) has the molecular formula C15H19N3O3 and a molecular weight of 289.33 g/mol. Its IUPAC name is 1-[3-(3-methylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[3-(3-methylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one
PubChem CID51087000
Molecular FormulaC15H19N3O3
Molecular Weight289.33 g/mol
Exact Mass289.14
IUPAC Name1-[3-(3-methylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one
SMILESCC1COCCN1C(=O)c1cccc(N2CCNC2=O)c1
InChIInChI=1S/C15H19N3O3/c1-11-10-21-8-7-17(11)14(19)12-3-2-4-13(9-12)18-6-5-16-15(18)20/h2-4,9,11H,5-8,10H2,1H3,(H,16,20)
InChIKeyBMFOPGLQVKKWJS-UHFFFAOYSA-N
XLogP1.08
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[3-(3-methylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one?
The IUPAC name of 1-[3-(3-methylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one (CID 51087000) is 1-[3-(3-methylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one.
What is the SMILES notation for 1-[3-(3-methylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one?
The canonical SMILES for 1-[3-(3-methylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one is CC1COCCN1C(=O)c1cccc(N2CCNC2=O)c1.
What is the InChIKey of 1-[3-(3-methylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one?
The InChIKey is BMFOPGLQVKKWJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-11-10-21-8-7-17(11)14(19)12-3-2-4-13(9-12)18-6-5-16-15(18)20/h2-4,9,11H,5-8,10H2,1H3,(H,16,20).
What are the key properties of 1-[3-(3-methylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one?
1-[3-(3-methylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one has a molecular weight of 289.33 g/mol, XLogP of 1.08, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(3-methylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one is sourced from PubChem (CID 51087000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).