N-[2-(4-fluorophenyl)sulfonylethyl]-2-[(2R)-morpholin-2-yl]acetamide

C14H19FN2O4S — CID 99715935

IUPACN-[2-(4-fluorophenyl)sulfonylethyl]-2-[(2R)-morpholin-2-yl]acetamide
SMILESO=C(C[C@@H]1CNCCO1)NCCS(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C14H19FN2O4S/c15-11-1-3-13(4-2-11)22(19,20)8-6-17-14(18)9-12-10-16-5-7-21-12/h1-4,12,16H,5-10H2,(H,17,18)/t12-/m1/s1
InChIKeyOTQXXZKEQSKVPQ-GFCCVEGCSA-N
MW330.38 g/mol
LogP0.09
Rot. Bonds6

About N-[2-(4-fluorophenyl)sulfonylethyl]-2-[(2R)-morpholin-2-yl]acetamide

N-[2-(4-fluorophenyl)sulfonylethyl]-2-[(2R)-morpholin-2-yl]acetamide (PubChem CID 99715935) has the molecular formula C14H19FN2O4S and a molecular weight of 330.38 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)sulfonylethyl]-2-[(2R)-morpholin-2-yl]acetamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)sulfonylethyl]-2-[(2R)-morpholin-2-yl]acetamide
PubChem CID99715935
Molecular FormulaC14H19FN2O4S
Molecular Weight330.38 g/mol
Exact Mass330.10
IUPAC NameN-[2-(4-fluorophenyl)sulfonylethyl]-2-[(2R)-morpholin-2-yl]acetamide
SMILESO=C(C[C@@H]1CNCCO1)NCCS(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C14H19FN2O4S/c15-11-1-3-13(4-2-11)22(19,20)8-6-17-14(18)9-12-10-16-5-7-21-12/h1-4,12,16H,5-10H2,(H,17,18)/t12-/m1/s1
InChIKeyOTQXXZKEQSKVPQ-GFCCVEGCSA-N
XLogP0.09
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.38
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)sulfonylethyl]-2-[(2R)-morpholin-2-yl]acetamide?
The IUPAC name of N-[2-(4-fluorophenyl)sulfonylethyl]-2-[(2R)-morpholin-2-yl]acetamide (CID 99715935) is N-[2-(4-fluorophenyl)sulfonylethyl]-2-[(2R)-morpholin-2-yl]acetamide.
What is the SMILES notation for N-[2-(4-fluorophenyl)sulfonylethyl]-2-[(2R)-morpholin-2-yl]acetamide?
The canonical SMILES for N-[2-(4-fluorophenyl)sulfonylethyl]-2-[(2R)-morpholin-2-yl]acetamide is O=C(C[C@@H]1CNCCO1)NCCS(=O)(=O)c1ccc(F)cc1.
What is the InChIKey of N-[2-(4-fluorophenyl)sulfonylethyl]-2-[(2R)-morpholin-2-yl]acetamide?
The InChIKey is OTQXXZKEQSKVPQ-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H19FN2O4S/c15-11-1-3-13(4-2-11)22(19,20)8-6-17-14(18)9-12-10-16-5-7-21-12/h1-4,12,16H,5-10H2,(H,17,18)/t12-/m1/s1.
What are the key properties of N-[2-(4-fluorophenyl)sulfonylethyl]-2-[(2R)-morpholin-2-yl]acetamide?
N-[2-(4-fluorophenyl)sulfonylethyl]-2-[(2R)-morpholin-2-yl]acetamide has a molecular weight of 330.38 g/mol, XLogP of 0.09, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)sulfonylethyl]-2-[(2R)-morpholin-2-yl]acetamide is sourced from PubChem (CID 99715935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).