N-(2-morpholin-4-ylpropyl)propane-1-sulfonamide

C10H22N2O3S — CID 75414492

IUPACN-(2-morpholin-4-ylpropyl)propane-1-sulfonamide
SMILESCCCS(=O)(=O)NCC(C)N1CCOCC1
InChIInChI=1S/C10H22N2O3S/c1-3-8-16(13,14)11-9-10(2)12-4-6-15-7-5-12/h10-11H,3-9H2,1-2H3
InChIKeyCGVNOIGOLFNUTK-UHFFFAOYSA-N
MW250.36 g/mol
LogP0.04
Rot. Bonds6

About N-(2-morpholin-4-ylpropyl)propane-1-sulfonamide

N-(2-morpholin-4-ylpropyl)propane-1-sulfonamide (PubChem CID 75414492) has the molecular formula C10H22N2O3S and a molecular weight of 250.36 g/mol. Its IUPAC name is N-(2-morpholin-4-ylpropyl)propane-1-sulfonamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylpropyl)propane-1-sulfonamide
PubChem CID75414492
Molecular FormulaC10H22N2O3S
Molecular Weight250.36 g/mol
Exact Mass250.14
IUPAC NameN-(2-morpholin-4-ylpropyl)propane-1-sulfonamide
SMILESCCCS(=O)(=O)NCC(C)N1CCOCC1
InChIInChI=1S/C10H22N2O3S/c1-3-8-16(13,14)11-9-10(2)12-4-6-15-7-5-12/h10-11H,3-9H2,1-2H3
InChIKeyCGVNOIGOLFNUTK-UHFFFAOYSA-N
XLogP0.04
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylpropyl)propane-1-sulfonamide?
The IUPAC name of N-(2-morpholin-4-ylpropyl)propane-1-sulfonamide (CID 75414492) is N-(2-morpholin-4-ylpropyl)propane-1-sulfonamide.
What is the SMILES notation for N-(2-morpholin-4-ylpropyl)propane-1-sulfonamide?
The canonical SMILES for N-(2-morpholin-4-ylpropyl)propane-1-sulfonamide is CCCS(=O)(=O)NCC(C)N1CCOCC1.
What is the InChIKey of N-(2-morpholin-4-ylpropyl)propane-1-sulfonamide?
The InChIKey is CGVNOIGOLFNUTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3S/c1-3-8-16(13,14)11-9-10(2)12-4-6-15-7-5-12/h10-11H,3-9H2,1-2H3.
What are the key properties of N-(2-morpholin-4-ylpropyl)propane-1-sulfonamide?
N-(2-morpholin-4-ylpropyl)propane-1-sulfonamide has a molecular weight of 250.36 g/mol, XLogP of 0.04, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylpropyl)propane-1-sulfonamide is sourced from PubChem (CID 75414492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).