N-cyclopropyl-N-ethyl-2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetamide

C15H28N4O4S — CID 55648073

IUPACN-cyclopropyl-N-ethyl-2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetamide
SMILESCCN(C(=O)CN1CCN(S(=O)(=O)N2CCOCC2)CC1)C1CC1
InChIInChI=1S/C15H28N4O4S/c1-2-19(14-3-4-14)15(20)13-16-5-7-17(8-6-16)24(21,22)18-9-11-23-12-10-18/h14H,2-13H2,1H3
InChIKeyPLWIUTPKMPZLJJ-UHFFFAOYSA-N
MW360.48 g/mol
LogP-0.81
Rot. Bonds6

About N-cyclopropyl-N-ethyl-2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetamide

N-cyclopropyl-N-ethyl-2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetamide (PubChem CID 55648073) has the molecular formula C15H28N4O4S and a molecular weight of 360.48 g/mol. Its IUPAC name is N-cyclopropyl-N-ethyl-2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-ethyl-2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetamide
PubChem CID55648073
Molecular FormulaC15H28N4O4S
Molecular Weight360.48 g/mol
Exact Mass360.18
IUPAC NameN-cyclopropyl-N-ethyl-2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetamide
SMILESCCN(C(=O)CN1CCN(S(=O)(=O)N2CCOCC2)CC1)C1CC1
InChIInChI=1S/C15H28N4O4S/c1-2-19(14-3-4-14)15(20)13-16-5-7-17(8-6-16)24(21,22)18-9-11-23-12-10-18/h14H,2-13H2,1H3
InChIKeyPLWIUTPKMPZLJJ-UHFFFAOYSA-N
XLogP-0.81
TPSA73.40 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 5-0.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-ethyl-2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetamide?
The IUPAC name of N-cyclopropyl-N-ethyl-2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetamide (CID 55648073) is N-cyclopropyl-N-ethyl-2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetamide.
What is the SMILES notation for N-cyclopropyl-N-ethyl-2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetamide?
The canonical SMILES for N-cyclopropyl-N-ethyl-2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetamide is CCN(C(=O)CN1CCN(S(=O)(=O)N2CCOCC2)CC1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-ethyl-2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetamide?
The InChIKey is PLWIUTPKMPZLJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O4S/c1-2-19(14-3-4-14)15(20)13-16-5-7-17(8-6-16)24(21,22)18-9-11-23-12-10-18/h14H,2-13H2,1H3.
What are the key properties of N-cyclopropyl-N-ethyl-2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetamide?
N-cyclopropyl-N-ethyl-2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetamide has a molecular weight of 360.48 g/mol, XLogP of -0.81, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-ethyl-2-(4-morpholin-4-ylsulfonylpiperazin-1-yl)acetamide is sourced from PubChem (CID 55648073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).