N-methyl-N-(2-piperidin-2-ylethyl)morpholine-4-sulfonamide

C12H25N3O3S — CID 43210416

IUPACN-methyl-N-(2-piperidin-2-ylethyl)morpholine-4-sulfonamide
SMILESCN(CCC1CCCCN1)S(=O)(=O)N1CCOCC1
InChIInChI=1S/C12H25N3O3S/c1-14(7-5-12-4-2-3-6-13-12)19(16,17)15-8-10-18-11-9-15/h12-13H,2-11H2,1H3
InChIKeyRDPYCEMQMGQDHQ-UHFFFAOYSA-N
MW291.42 g/mol
LogP0.03
Rot. Bonds5

About N-methyl-N-(2-piperidin-2-ylethyl)morpholine-4-sulfonamide

N-methyl-N-(2-piperidin-2-ylethyl)morpholine-4-sulfonamide (PubChem CID 43210416) has the molecular formula C12H25N3O3S and a molecular weight of 291.42 g/mol. Its IUPAC name is N-methyl-N-(2-piperidin-2-ylethyl)morpholine-4-sulfonamide.

Molecular Properties

Compound NameN-methyl-N-(2-piperidin-2-ylethyl)morpholine-4-sulfonamide
PubChem CID43210416
Molecular FormulaC12H25N3O3S
Molecular Weight291.42 g/mol
Exact Mass291.16
IUPAC NameN-methyl-N-(2-piperidin-2-ylethyl)morpholine-4-sulfonamide
SMILESCN(CCC1CCCCN1)S(=O)(=O)N1CCOCC1
InChIInChI=1S/C12H25N3O3S/c1-14(7-5-12-4-2-3-6-13-12)19(16,17)15-8-10-18-11-9-15/h12-13H,2-11H2,1H3
InChIKeyRDPYCEMQMGQDHQ-UHFFFAOYSA-N
XLogP0.03
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.42
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-piperidin-2-ylethyl)morpholine-4-sulfonamide?
The IUPAC name of N-methyl-N-(2-piperidin-2-ylethyl)morpholine-4-sulfonamide (CID 43210416) is N-methyl-N-(2-piperidin-2-ylethyl)morpholine-4-sulfonamide.
What is the SMILES notation for N-methyl-N-(2-piperidin-2-ylethyl)morpholine-4-sulfonamide?
The canonical SMILES for N-methyl-N-(2-piperidin-2-ylethyl)morpholine-4-sulfonamide is CN(CCC1CCCCN1)S(=O)(=O)N1CCOCC1.
What is the InChIKey of N-methyl-N-(2-piperidin-2-ylethyl)morpholine-4-sulfonamide?
The InChIKey is RDPYCEMQMGQDHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O3S/c1-14(7-5-12-4-2-3-6-13-12)19(16,17)15-8-10-18-11-9-15/h12-13H,2-11H2,1H3.
What are the key properties of N-methyl-N-(2-piperidin-2-ylethyl)morpholine-4-sulfonamide?
N-methyl-N-(2-piperidin-2-ylethyl)morpholine-4-sulfonamide has a molecular weight of 291.42 g/mol, XLogP of 0.03, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-piperidin-2-ylethyl)morpholine-4-sulfonamide is sourced from PubChem (CID 43210416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).