3-(4-fluorophenyl)-N-(6-methyl-2-pyridinyl)morpholine-4-sulfonamide

C16H18FN3O3S — CID 71210064

IUPAC3-(4-fluorophenyl)-N-(6-methyl-2-pyridinyl)morpholine-4-sulfonamide
SMILESCc1cccc(NS(=O)(=O)N2CCOCC2c2ccc(F)cc2)n1
InChIInChI=1S/C16H18FN3O3S/c1-12-3-2-4-16(18-12)19-24(21,22)20-9-10-23-11-15(20)13-5-7-14(17)8-6-13/h2-8,15H,9-11H2,1H3,(H,18,19)
InChIKeyISSUNFSBLFQPAW-UHFFFAOYSA-N
MW351.40 g/mol
LogP2.26
Rot. Bonds4

About 3-(4-fluorophenyl)-N-(6-methyl-2-pyridinyl)morpholine-4-sulfonamide

3-(4-fluorophenyl)-N-(6-methyl-2-pyridinyl)morpholine-4-sulfonamide (PubChem CID 71210064) has the molecular formula C16H18FN3O3S and a molecular weight of 351.40 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-N-(6-methyl-2-pyridinyl)morpholine-4-sulfonamide.

Molecular Properties

Compound Name3-(4-fluorophenyl)-N-(6-methyl-2-pyridinyl)morpholine-4-sulfonamide
PubChem CID71210064
Molecular FormulaC16H18FN3O3S
Molecular Weight351.40 g/mol
Exact Mass351.11
IUPAC Name3-(4-fluorophenyl)-N-(6-methyl-2-pyridinyl)morpholine-4-sulfonamide
SMILESCc1cccc(NS(=O)(=O)N2CCOCC2c2ccc(F)cc2)n1
InChIInChI=1S/C16H18FN3O3S/c1-12-3-2-4-16(18-12)19-24(21,22)20-9-10-23-11-15(20)13-5-7-14(17)8-6-13/h2-8,15H,9-11H2,1H3,(H,18,19)
InChIKeyISSUNFSBLFQPAW-UHFFFAOYSA-N
XLogP2.26
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.40
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-N-(6-methyl-2-pyridinyl)morpholine-4-sulfonamide?
The IUPAC name of 3-(4-fluorophenyl)-N-(6-methyl-2-pyridinyl)morpholine-4-sulfonamide (CID 71210064) is 3-(4-fluorophenyl)-N-(6-methyl-2-pyridinyl)morpholine-4-sulfonamide.
What is the SMILES notation for 3-(4-fluorophenyl)-N-(6-methyl-2-pyridinyl)morpholine-4-sulfonamide?
The canonical SMILES for 3-(4-fluorophenyl)-N-(6-methyl-2-pyridinyl)morpholine-4-sulfonamide is Cc1cccc(NS(=O)(=O)N2CCOCC2c2ccc(F)cc2)n1.
What is the InChIKey of 3-(4-fluorophenyl)-N-(6-methyl-2-pyridinyl)morpholine-4-sulfonamide?
The InChIKey is ISSUNFSBLFQPAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FN3O3S/c1-12-3-2-4-16(18-12)19-24(21,22)20-9-10-23-11-15(20)13-5-7-14(17)8-6-13/h2-8,15H,9-11H2,1H3,(H,18,19).
What are the key properties of 3-(4-fluorophenyl)-N-(6-methyl-2-pyridinyl)morpholine-4-sulfonamide?
3-(4-fluorophenyl)-N-(6-methyl-2-pyridinyl)morpholine-4-sulfonamide has a molecular weight of 351.40 g/mol, XLogP of 2.26, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-N-(6-methyl-2-pyridinyl)morpholine-4-sulfonamide is sourced from PubChem (CID 71210064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).