1-[4-(2,2-dimethylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one

C16H21N3O3 — CID 86981324

IUPAC1-[4-(2,2-dimethylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one
SMILESCC1(C)CN(C(=O)c2ccc(N3CCNC3=O)cc2)CCO1
InChIInChI=1S/C16H21N3O3/c1-16(2)11-18(9-10-22-16)14(20)12-3-5-13(6-4-12)19-8-7-17-15(19)21/h3-6H,7-11H2,1-2H3,(H,17,21)
InChIKeyAXZVGGVTFBKJKN-UHFFFAOYSA-N
MW303.36 g/mol
LogP1.47
Rot. Bonds2

About 1-[4-(2,2-dimethylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one

1-[4-(2,2-dimethylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one (PubChem CID 86981324) has the molecular formula C16H21N3O3 and a molecular weight of 303.36 g/mol. Its IUPAC name is 1-[4-(2,2-dimethylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[4-(2,2-dimethylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one
PubChem CID86981324
Molecular FormulaC16H21N3O3
Molecular Weight303.36 g/mol
Exact Mass303.16
IUPAC Name1-[4-(2,2-dimethylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one
SMILESCC1(C)CN(C(=O)c2ccc(N3CCNC3=O)cc2)CCO1
InChIInChI=1S/C16H21N3O3/c1-16(2)11-18(9-10-22-16)14(20)12-3-5-13(6-4-12)19-8-7-17-15(19)21/h3-6H,7-11H2,1-2H3,(H,17,21)
InChIKeyAXZVGGVTFBKJKN-UHFFFAOYSA-N
XLogP1.47
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.36
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2,2-dimethylmorpholin-4-yl)-(4-hydroxy-3-methylphenyl)methanone
CID 113357496
(4-amino-3-hydroxyphenyl)-(2,2-dimethylmorpholin-4-yl)methanone
CID 107074174
(3,5-diaminophenyl)-(2,2-dimethylmorpholin-4-yl)methanone
CID 61093702
ethyl 4-[4-(2-oxoimidazolidin-1-yl)benzoyl]piperazine-1-carboxylate
CID 51298973
N,N,3,3-tetramethyl-4-[4-(2-oxoimidazolidin-1-yl)benzoyl]piperazine-1-carboxamide
CID 75401006
1-[4-(4,4-difluoro-3-methylpiperidine-1-carbonyl)phenyl]imidazolidin-2-one
CID 136543686
(3-chloro-4-hydroxyphenyl)-(2,2-dimethylmorpholin-4-yl)methanone
CID 43430913
(2,2-dimethylmorpholin-4-yl)-(2-fluoro-4-pyridinyl)methanone
CID 61294351
(2,2-dimethylmorpholin-4-yl)-[4-(imidazol-1-ylmethyl)phenyl]methanone
CID 86991463
(3-bromo-4-chlorophenyl)-(2,2-dimethylmorpholin-4-yl)methanone
CID 113329851
4-(2,2-dimethylmorpholine-4-carbonyl)-N-methyl-N-propan-2-ylbenzenesulfonamide
CID 86981327
1-[4-[3-(methylamino)piperidine-1-carbonyl]phenyl]imidazolidin-2-one
CID 119490960

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2,2-dimethylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one?
The IUPAC name of 1-[4-(2,2-dimethylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one (CID 86981324) is 1-[4-(2,2-dimethylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one.
What is the SMILES notation for 1-[4-(2,2-dimethylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one?
The canonical SMILES for 1-[4-(2,2-dimethylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one is CC1(C)CN(C(=O)c2ccc(N3CCNC3=O)cc2)CCO1.
What is the InChIKey of 1-[4-(2,2-dimethylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one?
The InChIKey is AXZVGGVTFBKJKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O3/c1-16(2)11-18(9-10-22-16)14(20)12-3-5-13(6-4-12)19-8-7-17-15(19)21/h3-6H,7-11H2,1-2H3,(H,17,21).
What are the key properties of 1-[4-(2,2-dimethylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one?
1-[4-(2,2-dimethylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one has a molecular weight of 303.36 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2,2-dimethylmorpholine-4-carbonyl)phenyl]imidazolidin-2-one is sourced from PubChem (CID 86981324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).