1-[2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetyl]imidazolidin-2-one

C13H23N5O5S — CID 39998527

IUPAC1-[2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetyl]imidazolidin-2-one
SMILESO=C(CN1CCN(S(=O)(=O)N2CCOCC2)CC1)N1CCNC1=O
InChIInChI=1S/C13H23N5O5S/c19-12(18-2-1-14-13(18)20)11-15-3-5-16(6-4-15)24(21,22)17-7-9-23-10-8-17/h1-11H2,(H,14,20)
InChIKeyLRAAKZQODOQQBR-UHFFFAOYSA-N
MW361.42 g/mol
LogP-2.27
Rot. Bonds4

About 1-[2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetyl]imidazolidin-2-one

1-[2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetyl]imidazolidin-2-one (PubChem CID 39998527) has the molecular formula C13H23N5O5S and a molecular weight of 361.42 g/mol. Its IUPAC name is 1-[2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetyl]imidazolidin-2-one
PubChem CID39998527
Molecular FormulaC13H23N5O5S
Molecular Weight361.42 g/mol
Exact Mass361.14
IUPAC Name1-[2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetyl]imidazolidin-2-one
SMILESO=C(CN1CCN(S(=O)(=O)N2CCOCC2)CC1)N1CCNC1=O
InChIInChI=1S/C13H23N5O5S/c19-12(18-2-1-14-13(18)20)11-15-3-5-16(6-4-15)24(21,22)17-7-9-23-10-8-17/h1-11H2,(H,14,20)
InChIKeyLRAAKZQODOQQBR-UHFFFAOYSA-N
XLogP-2.27
TPSA102.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.42
LogP ≤ 5-2.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetyl]imidazolidin-2-one?
The IUPAC name of 1-[2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetyl]imidazolidin-2-one (CID 39998527) is 1-[2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetyl]imidazolidin-2-one is O=C(CN1CCN(S(=O)(=O)N2CCOCC2)CC1)N1CCNC1=O.
What is the InChIKey of 1-[2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetyl]imidazolidin-2-one?
The InChIKey is LRAAKZQODOQQBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O5S/c19-12(18-2-1-14-13(18)20)11-15-3-5-16(6-4-15)24(21,22)17-7-9-23-10-8-17/h1-11H2,(H,14,20).
What are the key properties of 1-[2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetyl]imidazolidin-2-one?
1-[2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetyl]imidazolidin-2-one has a molecular weight of 361.42 g/mol, XLogP of -2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetyl]imidazolidin-2-one is sourced from PubChem (CID 39998527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).