[3-(4-chlorophenyl)sulfonyl-2-methylimidazolidin-1-yl]-morpholin-4-ylmethanone

C15H20ClN3O4S — CID 6498827

IUPAC[3-(4-chlorophenyl)sulfonyl-2-methylimidazolidin-1-yl]-morpholin-4-ylmethanone
SMILESCC1N(C(=O)N2CCOCC2)CCN1S(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C15H20ClN3O4S/c1-12-18(15(20)17-8-10-23-11-9-17)6-7-19(12)24(21,22)14-4-2-13(16)3-5-14/h2-5,12H,6-11H2,1H3
InChIKeyQSSSKWXJFQBHOD-UHFFFAOYSA-N
MW373.86 g/mol
LogP1.44
Rot. Bonds2

About [3-(4-chlorophenyl)sulfonyl-2-methylimidazolidin-1-yl]-morpholin-4-ylmethanone

[3-(4-chlorophenyl)sulfonyl-2-methylimidazolidin-1-yl]-morpholin-4-ylmethanone (PubChem CID 6498827) has the molecular formula C15H20ClN3O4S and a molecular weight of 373.86 g/mol. Its IUPAC name is [3-(4-chlorophenyl)sulfonyl-2-methylimidazolidin-1-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[3-(4-chlorophenyl)sulfonyl-2-methylimidazolidin-1-yl]-morpholin-4-ylmethanone
PubChem CID6498827
Molecular FormulaC15H20ClN3O4S
Molecular Weight373.86 g/mol
Exact Mass373.09
IUPAC Name[3-(4-chlorophenyl)sulfonyl-2-methylimidazolidin-1-yl]-morpholin-4-ylmethanone
SMILESCC1N(C(=O)N2CCOCC2)CCN1S(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C15H20ClN3O4S/c1-12-18(15(20)17-8-10-23-11-9-17)6-7-19(12)24(21,22)14-4-2-13(16)3-5-14/h2-5,12H,6-11H2,1H3
InChIKeyQSSSKWXJFQBHOD-UHFFFAOYSA-N
XLogP1.44
TPSA70.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.86
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-(4-chlorophenyl)sulfonyl-2-methylimidazolidin-1-yl]-morpholin-4-ylmethanone?
The IUPAC name of [3-(4-chlorophenyl)sulfonyl-2-methylimidazolidin-1-yl]-morpholin-4-ylmethanone (CID 6498827) is [3-(4-chlorophenyl)sulfonyl-2-methylimidazolidin-1-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [3-(4-chlorophenyl)sulfonyl-2-methylimidazolidin-1-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [3-(4-chlorophenyl)sulfonyl-2-methylimidazolidin-1-yl]-morpholin-4-ylmethanone is CC1N(C(=O)N2CCOCC2)CCN1S(=O)(=O)c1ccc(Cl)cc1.
What is the InChIKey of [3-(4-chlorophenyl)sulfonyl-2-methylimidazolidin-1-yl]-morpholin-4-ylmethanone?
The InChIKey is QSSSKWXJFQBHOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClN3O4S/c1-12-18(15(20)17-8-10-23-11-9-17)6-7-19(12)24(21,22)14-4-2-13(16)3-5-14/h2-5,12H,6-11H2,1H3.
What are the key properties of [3-(4-chlorophenyl)sulfonyl-2-methylimidazolidin-1-yl]-morpholin-4-ylmethanone?
[3-(4-chlorophenyl)sulfonyl-2-methylimidazolidin-1-yl]-morpholin-4-ylmethanone has a molecular weight of 373.86 g/mol, XLogP of 1.44, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-chlorophenyl)sulfonyl-2-methylimidazolidin-1-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 6498827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).