6-morpholin-4-yl-N-(oxolan-2-ylmethyl)pyridine-3-sulfonamide

C14H21N3O4S — CID 2738744

IUPAC6-morpholin-4-yl-N-(oxolan-2-ylmethyl)pyridine-3-sulfonamide
SMILESO=S(=O)(NCC1CCCO1)c1ccc(N2CCOCC2)nc1
InChIInChI=1S/C14H21N3O4S/c18-22(19,16-10-12-2-1-7-21-12)13-3-4-14(15-11-13)17-5-8-20-9-6-17/h3-4,11-12,16H,1-2,5-10H2
InChIKeyYTDRRDTWJJUSDO-UHFFFAOYSA-N
MW327.41 g/mol
LogP0.38
Rot. Bonds5

About 6-morpholin-4-yl-N-(oxolan-2-ylmethyl)pyridine-3-sulfonamide

6-morpholin-4-yl-N-(oxolan-2-ylmethyl)pyridine-3-sulfonamide (PubChem CID 2738744) has the molecular formula C14H21N3O4S and a molecular weight of 327.41 g/mol. Its IUPAC name is 6-morpholin-4-yl-N-(oxolan-2-ylmethyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-morpholin-4-yl-N-(oxolan-2-ylmethyl)pyridine-3-sulfonamide
PubChem CID2738744
Molecular FormulaC14H21N3O4S
Molecular Weight327.41 g/mol
Exact Mass327.13
IUPAC Name6-morpholin-4-yl-N-(oxolan-2-ylmethyl)pyridine-3-sulfonamide
SMILESO=S(=O)(NCC1CCCO1)c1ccc(N2CCOCC2)nc1
InChIInChI=1S/C14H21N3O4S/c18-22(19,16-10-12-2-1-7-21-12)13-3-4-14(15-11-13)17-5-8-20-9-6-17/h3-4,11-12,16H,1-2,5-10H2
InChIKeyYTDRRDTWJJUSDO-UHFFFAOYSA-N
XLogP0.38
TPSA80.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.41
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-morpholin-4-yl-N-(oxolan-2-ylmethyl)pyridine-3-sulfonamide?
The IUPAC name of 6-morpholin-4-yl-N-(oxolan-2-ylmethyl)pyridine-3-sulfonamide (CID 2738744) is 6-morpholin-4-yl-N-(oxolan-2-ylmethyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-morpholin-4-yl-N-(oxolan-2-ylmethyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-morpholin-4-yl-N-(oxolan-2-ylmethyl)pyridine-3-sulfonamide is O=S(=O)(NCC1CCCO1)c1ccc(N2CCOCC2)nc1.
What is the InChIKey of 6-morpholin-4-yl-N-(oxolan-2-ylmethyl)pyridine-3-sulfonamide?
The InChIKey is YTDRRDTWJJUSDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O4S/c18-22(19,16-10-12-2-1-7-21-12)13-3-4-14(15-11-13)17-5-8-20-9-6-17/h3-4,11-12,16H,1-2,5-10H2.
What are the key properties of 6-morpholin-4-yl-N-(oxolan-2-ylmethyl)pyridine-3-sulfonamide?
6-morpholin-4-yl-N-(oxolan-2-ylmethyl)pyridine-3-sulfonamide has a molecular weight of 327.41 g/mol, XLogP of 0.38, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-morpholin-4-yl-N-(oxolan-2-ylmethyl)pyridine-3-sulfonamide is sourced from PubChem (CID 2738744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).