N-(3-hydroxypropyl)morpholine-4-sulfonamide

C7H16N2O4S — CID 43501576

IUPACN-(3-hydroxypropyl)morpholine-4-sulfonamide
SMILESO=S(=O)(NCCCO)N1CCOCC1
InChIInChI=1S/C7H16N2O4S/c10-5-1-2-8-14(11,12)9-3-6-13-7-4-9/h8,10H,1-7H2
InChIKeyGPLDSKMNADCLKK-UHFFFAOYSA-N
MW224.28 g/mol
LogP-1.46
Rot. Bonds5

About N-(3-hydroxypropyl)morpholine-4-sulfonamide

N-(3-hydroxypropyl)morpholine-4-sulfonamide (PubChem CID 43501576) has the molecular formula C7H16N2O4S and a molecular weight of 224.28 g/mol. Its IUPAC name is N-(3-hydroxypropyl)morpholine-4-sulfonamide.

Molecular Properties

Compound NameN-(3-hydroxypropyl)morpholine-4-sulfonamide
PubChem CID43501576
Molecular FormulaC7H16N2O4S
Molecular Weight224.28 g/mol
Exact Mass224.08
IUPAC NameN-(3-hydroxypropyl)morpholine-4-sulfonamide
SMILESO=S(=O)(NCCCO)N1CCOCC1
InChIInChI=1S/C7H16N2O4S/c10-5-1-2-8-14(11,12)9-3-6-13-7-4-9/h8,10H,1-7H2
InChIKeyGPLDSKMNADCLKK-UHFFFAOYSA-N
XLogP-1.46
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.28
LogP ≤ 5-1.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxypropyl)morpholine-4-sulfonamide?
The IUPAC name of N-(3-hydroxypropyl)morpholine-4-sulfonamide (CID 43501576) is N-(3-hydroxypropyl)morpholine-4-sulfonamide.
What is the SMILES notation for N-(3-hydroxypropyl)morpholine-4-sulfonamide?
The canonical SMILES for N-(3-hydroxypropyl)morpholine-4-sulfonamide is O=S(=O)(NCCCO)N1CCOCC1.
What is the InChIKey of N-(3-hydroxypropyl)morpholine-4-sulfonamide?
The InChIKey is GPLDSKMNADCLKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O4S/c10-5-1-2-8-14(11,12)9-3-6-13-7-4-9/h8,10H,1-7H2.
What are the key properties of N-(3-hydroxypropyl)morpholine-4-sulfonamide?
N-(3-hydroxypropyl)morpholine-4-sulfonamide has a molecular weight of 224.28 g/mol, XLogP of -1.46, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxypropyl)morpholine-4-sulfonamide is sourced from PubChem (CID 43501576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).