2-(4-fluorophenyl)-6-methyl-4-pyridin-3-ylsulfonylmorpholine

C16H17FN2O3S — CID 71997381

IUPAC2-(4-fluorophenyl)-6-methyl-4-pyridin-3-ylsulfonylmorpholine
SMILESCC1CN(S(=O)(=O)c2cccnc2)CC(c2ccc(F)cc2)O1
InChIInChI=1S/C16H17FN2O3S/c1-12-10-19(23(20,21)15-3-2-8-18-9-15)11-16(22-12)13-4-6-14(17)7-5-13/h2-9,12,16H,10-11H2,1H3
InChIKeyRCMDCQOLFPZENI-UHFFFAOYSA-N
MW336.39 g/mol
LogP2.37
Rot. Bonds3

About 2-(4-fluorophenyl)-6-methyl-4-pyridin-3-ylsulfonylmorpholine

2-(4-fluorophenyl)-6-methyl-4-pyridin-3-ylsulfonylmorpholine (PubChem CID 71997381) has the molecular formula C16H17FN2O3S and a molecular weight of 336.39 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-6-methyl-4-pyridin-3-ylsulfonylmorpholine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-6-methyl-4-pyridin-3-ylsulfonylmorpholine
PubChem CID71997381
Molecular FormulaC16H17FN2O3S
Molecular Weight336.39 g/mol
Exact Mass336.09
IUPAC Name2-(4-fluorophenyl)-6-methyl-4-pyridin-3-ylsulfonylmorpholine
SMILESCC1CN(S(=O)(=O)c2cccnc2)CC(c2ccc(F)cc2)O1
InChIInChI=1S/C16H17FN2O3S/c1-12-10-19(23(20,21)15-3-2-8-18-9-15)11-16(22-12)13-4-6-14(17)7-5-13/h2-9,12,16H,10-11H2,1H3
InChIKeyRCMDCQOLFPZENI-UHFFFAOYSA-N
XLogP2.37
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-{2-[Bis-(4-fluoro-phenyl)-methoxy]-ethyl}-4-(3-pyridin-3-yl-propyl)-piperazine
CID 10599695
1-{2-[Bis-(4-fluoro-phenyl)-methoxy]-ethyl}-4-((E)-3-pyridin-3-yl-allyl)-piperazine
CID 10789674
1-(4-((R)-2-methyl-4-(2-(pyridin-4-yl)ethyl)piperazin-1-ylsulfonyl)phenyl)ethanol
CID 44564975
4-[(2S)-4-[4-(3-fluoro-4-pyridinyl)-1-methyl-6-oxopyrimidin-2-yl]morpholin-2-yl]-N,N-dimethylbenzenesulfonamide
CID 57877858
1-Phenyl-2-(4-pyridin-3-ylsulfonylpiperazin-1-yl)ethanol
CID 45814153
4-ethoxy-3-fluoro-N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)benzenesulfonamide
CID 52906848
2-(4-Fluorophenyl)-4-(2-pyridin-4-ylethyl)morpholine
CID 53517064
4-fluoro-N-(2-methoxyethyl)-2-methyl-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 53541368
2-fluoro-N-(2-methoxyethyl)-5-methyl-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 53541721
N-[3-oxo-3-(2-phenylmorpholin-4-yl)propyl]pyridine-3-sulfonamide
CID 56808404
2-Phenyl-4-(2-pyridin-4-ylethyl)morpholine
CID 56812062
N-[2-(2-Fluorophenyl)-2-methoxypropyl]pyridine-3-sulfonamide
CID 71810663

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-6-methyl-4-pyridin-3-ylsulfonylmorpholine?
The IUPAC name of 2-(4-fluorophenyl)-6-methyl-4-pyridin-3-ylsulfonylmorpholine (CID 71997381) is 2-(4-fluorophenyl)-6-methyl-4-pyridin-3-ylsulfonylmorpholine.
What is the SMILES notation for 2-(4-fluorophenyl)-6-methyl-4-pyridin-3-ylsulfonylmorpholine?
The canonical SMILES for 2-(4-fluorophenyl)-6-methyl-4-pyridin-3-ylsulfonylmorpholine is CC1CN(S(=O)(=O)c2cccnc2)CC(c2ccc(F)cc2)O1.
What is the InChIKey of 2-(4-fluorophenyl)-6-methyl-4-pyridin-3-ylsulfonylmorpholine?
The InChIKey is RCMDCQOLFPZENI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O3S/c1-12-10-19(23(20,21)15-3-2-8-18-9-15)11-16(22-12)13-4-6-14(17)7-5-13/h2-9,12,16H,10-11H2,1H3.
What are the key properties of 2-(4-fluorophenyl)-6-methyl-4-pyridin-3-ylsulfonylmorpholine?
2-(4-fluorophenyl)-6-methyl-4-pyridin-3-ylsulfonylmorpholine has a molecular weight of 336.39 g/mol, XLogP of 2.37, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-6-methyl-4-pyridin-3-ylsulfonylmorpholine is sourced from PubChem (CID 71997381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).