3-(4-chlorophenyl)-5-morpholin-4-yl-4H-imidazol-2-one

C13H14ClN3O2 — CID 3083511

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IUPAC3-(4-chlorophenyl)-5-morpholin-4-yl-4H-imidazol-2-one
SMILESO=C1N=C(N2CCOCC2)CN1c1ccc(Cl)cc1
InChIInChI=1S/C13H14ClN3O2/c14-10-1-3-11(4-2-10)17-9-12(15-13(17)18)16-5-7-19-8-6-16/h1-4H,5-9H2
InChIKeyIQHYCZKIFIHTAI-UHFFFAOYSA-N
MW279.73 g/mol
LogP2.01
Rot. Bonds1

About 3-(4-chlorophenyl)-5-morpholin-4-yl-4H-imidazol-2-one

3-(4-chlorophenyl)-5-morpholin-4-yl-4H-imidazol-2-one (PubChem CID 3083511) has the molecular formula C13H14ClN3O2 and a molecular weight of 279.73 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-5-morpholin-4-yl-4H-imidazol-2-one.

Molecular Properties

Compound Name3-(4-chlorophenyl)-5-morpholin-4-yl-4H-imidazol-2-one
PubChem CID3083511
Molecular FormulaC13H14ClN3O2
Molecular Weight279.73 g/mol
Exact Mass279.08
IUPAC Name3-(4-chlorophenyl)-5-morpholin-4-yl-4H-imidazol-2-one
SMILESO=C1N=C(N2CCOCC2)CN1c1ccc(Cl)cc1
InChIInChI=1S/C13H14ClN3O2/c14-10-1-3-11(4-2-10)17-9-12(15-13(17)18)16-5-7-19-8-6-16/h1-4H,5-9H2
InChIKeyIQHYCZKIFIHTAI-UHFFFAOYSA-N
XLogP2.01
TPSA45.14 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.73
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chlorophenyl)morpholine-4-carboxamide
CID 759971
[4-(4-Chlorophenyl)piperazin-1-yl](morpholin-4-yl)methanone
CID 976980
N-(4-chlorophenyl)-N'-[2-(4-morpholinyl)ethyl]urea
CID 873825
1-(4-Chlorophenyl)-4-(morpholin-4-yl)-1,5-dihydro-2H-pyrrol-2-one
CID 9882126
1-(4-chlorophenyl)-4-(piperidin-1-yl)-1H-imidazol-2(5H)-one
CID 11277418
5-morpholin-4-yl-3-phenyl-4H-imidazol-2-one
CID 11492485
1-(4-Chlorophenyl)-4-(pyrrolidin-1-yl)-1,5-dihydro-2H-imidazol-2-one
CID 11499925
3-(4-iodophenyl)-5-morpholin-4-yl-4H-imidazol-2-one
CID 11603142
3-(4-chlorophenyl)-5-piperazin-1-yl-4H-imidazol-2-one
CID 44408530
2-(4-Chlorophenyl)-5-methyl-4-(2-morpholin-4-ylethyl)-1,2,4-triazol-3-one
CID 71652840
3-(4-fluorophenyl)-5-morpholin-4-yl-4H-imidazol-2-one
CID 11499918
3-(3-chlorophenyl)-5-morpholin-4-yl-4H-imidazol-2-one
CID 11637708

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-5-morpholin-4-yl-4H-imidazol-2-one?
The IUPAC name of 3-(4-chlorophenyl)-5-morpholin-4-yl-4H-imidazol-2-one (CID 3083511) is 3-(4-chlorophenyl)-5-morpholin-4-yl-4H-imidazol-2-one.
What is the SMILES notation for 3-(4-chlorophenyl)-5-morpholin-4-yl-4H-imidazol-2-one?
The canonical SMILES for 3-(4-chlorophenyl)-5-morpholin-4-yl-4H-imidazol-2-one is O=C1N=C(N2CCOCC2)CN1c1ccc(Cl)cc1.
What is the InChIKey of 3-(4-chlorophenyl)-5-morpholin-4-yl-4H-imidazol-2-one?
The InChIKey is IQHYCZKIFIHTAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14ClN3O2/c14-10-1-3-11(4-2-10)17-9-12(15-13(17)18)16-5-7-19-8-6-16/h1-4H,5-9H2.
What are the key properties of 3-(4-chlorophenyl)-5-morpholin-4-yl-4H-imidazol-2-one?
3-(4-chlorophenyl)-5-morpholin-4-yl-4H-imidazol-2-one has a molecular weight of 279.73 g/mol, XLogP of 2.01, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-5-morpholin-4-yl-4H-imidazol-2-one is sourced from PubChem (CID 3083511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).