N,N-dimethyl-4-(morpholine-4-carbonyl)piperazine-1-sulfonamide

C11H22N4O4S — CID 2147556

IUPACN,N-dimethyl-4-(morpholine-4-carbonyl)piperazine-1-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCN(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C11H22N4O4S/c1-12(2)20(17,18)15-5-3-13(4-6-15)11(16)14-7-9-19-10-8-14/h3-10H2,1-2H3
InChIKeyBIUUYBJDJUKNJK-UHFFFAOYSA-N
MW306.39 g/mol
LogP-1.14
Rot. Bonds2

About N,N-dimethyl-4-(morpholine-4-carbonyl)piperazine-1-sulfonamide

N,N-dimethyl-4-(morpholine-4-carbonyl)piperazine-1-sulfonamide (PubChem CID 2147556) has the molecular formula C11H22N4O4S and a molecular weight of 306.39 g/mol. Its IUPAC name is N,N-dimethyl-4-(morpholine-4-carbonyl)piperazine-1-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-4-(morpholine-4-carbonyl)piperazine-1-sulfonamide
PubChem CID2147556
Molecular FormulaC11H22N4O4S
Molecular Weight306.39 g/mol
Exact Mass306.14
IUPAC NameN,N-dimethyl-4-(morpholine-4-carbonyl)piperazine-1-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCN(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C11H22N4O4S/c1-12(2)20(17,18)15-5-3-13(4-6-15)11(16)14-7-9-19-10-8-14/h3-10H2,1-2H3
InChIKeyBIUUYBJDJUKNJK-UHFFFAOYSA-N
XLogP-1.14
TPSA73.40 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.39
LogP ≤ 5-1.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(morpholine-4-carbonyl)piperazine-1-sulfonamide?
The IUPAC name of N,N-dimethyl-4-(morpholine-4-carbonyl)piperazine-1-sulfonamide (CID 2147556) is N,N-dimethyl-4-(morpholine-4-carbonyl)piperazine-1-sulfonamide.
What is the SMILES notation for N,N-dimethyl-4-(morpholine-4-carbonyl)piperazine-1-sulfonamide?
The canonical SMILES for N,N-dimethyl-4-(morpholine-4-carbonyl)piperazine-1-sulfonamide is CN(C)S(=O)(=O)N1CCN(C(=O)N2CCOCC2)CC1.
What is the InChIKey of N,N-dimethyl-4-(morpholine-4-carbonyl)piperazine-1-sulfonamide?
The InChIKey is BIUUYBJDJUKNJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O4S/c1-12(2)20(17,18)15-5-3-13(4-6-15)11(16)14-7-9-19-10-8-14/h3-10H2,1-2H3.
What are the key properties of N,N-dimethyl-4-(morpholine-4-carbonyl)piperazine-1-sulfonamide?
N,N-dimethyl-4-(morpholine-4-carbonyl)piperazine-1-sulfonamide has a molecular weight of 306.39 g/mol, XLogP of -1.14, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(morpholine-4-carbonyl)piperazine-1-sulfonamide is sourced from PubChem (CID 2147556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).