N-(furan-2-ylmethyl)morpholine-4-sulfonamide

C9H14N2O4S — CID 2235318

IUPACN-(furan-2-ylmethyl)morpholine-4-sulfonamide
SMILESO=S(=O)(NCc1ccco1)N1CCOCC1
InChIInChI=1S/C9H14N2O4S/c12-16(13,11-3-6-14-7-4-11)10-8-9-2-1-5-15-9/h1-2,5,10H,3-4,6-8H2
InChIKeyKDEJVYQVBVRWRA-UHFFFAOYSA-N
MW246.29 g/mol
LogP-0.05
Rot. Bonds4

About N-(furan-2-ylmethyl)morpholine-4-sulfonamide

N-(furan-2-ylmethyl)morpholine-4-sulfonamide (PubChem CID 2235318) has the molecular formula C9H14N2O4S and a molecular weight of 246.29 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)morpholine-4-sulfonamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)morpholine-4-sulfonamide
PubChem CID2235318
Molecular FormulaC9H14N2O4S
Molecular Weight246.29 g/mol
Exact Mass246.07
IUPAC NameN-(furan-2-ylmethyl)morpholine-4-sulfonamide
SMILESO=S(=O)(NCc1ccco1)N1CCOCC1
InChIInChI=1S/C9H14N2O4S/c12-16(13,11-3-6-14-7-4-11)10-8-9-2-1-5-15-9/h1-2,5,10H,3-4,6-8H2
InChIKeyKDEJVYQVBVRWRA-UHFFFAOYSA-N
XLogP-0.05
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.29
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)morpholine-4-sulfonamide?
The IUPAC name of N-(furan-2-ylmethyl)morpholine-4-sulfonamide (CID 2235318) is N-(furan-2-ylmethyl)morpholine-4-sulfonamide.
What is the SMILES notation for N-(furan-2-ylmethyl)morpholine-4-sulfonamide?
The canonical SMILES for N-(furan-2-ylmethyl)morpholine-4-sulfonamide is O=S(=O)(NCc1ccco1)N1CCOCC1.
What is the InChIKey of N-(furan-2-ylmethyl)morpholine-4-sulfonamide?
The InChIKey is KDEJVYQVBVRWRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O4S/c12-16(13,11-3-6-14-7-4-11)10-8-9-2-1-5-15-9/h1-2,5,10H,3-4,6-8H2.
What are the key properties of N-(furan-2-ylmethyl)morpholine-4-sulfonamide?
N-(furan-2-ylmethyl)morpholine-4-sulfonamide has a molecular weight of 246.29 g/mol, XLogP of -0.05, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)morpholine-4-sulfonamide is sourced from PubChem (CID 2235318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).