2-[(5-fluoro-2-methoxyphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)propanamide

C16H24FN3O5S — CID 43890677

IUPAC2-[(5-fluoro-2-methoxyphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)propanamide
SMILESCOc1ccc(F)cc1S(=O)(=O)NC(C)C(=O)NCCN1CCOCC1
InChIInChI=1S/C16H24FN3O5S/c1-12(16(21)18-5-6-20-7-9-25-10-8-20)19-26(22,23)15-11-13(17)3-4-14(15)24-2/h3-4,11-12,19H,5-10H2,1-2H3,(H,18,21)
InChIKeyFIDFSPBMGRTQLO-UHFFFAOYSA-N
MW389.45 g/mol
LogP-0.05
Rot. Bonds8

About 2-[(5-fluoro-2-methoxyphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)propanamide

2-[(5-fluoro-2-methoxyphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)propanamide (PubChem CID 43890677) has the molecular formula C16H24FN3O5S and a molecular weight of 389.45 g/mol. Its IUPAC name is 2-[(5-fluoro-2-methoxyphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)propanamide.

Molecular Properties

Compound Name2-[(5-fluoro-2-methoxyphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)propanamide
PubChem CID43890677
Molecular FormulaC16H24FN3O5S
Molecular Weight389.45 g/mol
Exact Mass389.14
IUPAC Name2-[(5-fluoro-2-methoxyphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)propanamide
SMILESCOc1ccc(F)cc1S(=O)(=O)NC(C)C(=O)NCCN1CCOCC1
InChIInChI=1S/C16H24FN3O5S/c1-12(16(21)18-5-6-20-7-9-25-10-8-20)19-26(22,23)15-11-13(17)3-4-14(15)24-2/h3-4,11-12,19H,5-10H2,1-2H3,(H,18,21)
InChIKeyFIDFSPBMGRTQLO-UHFFFAOYSA-N
XLogP-0.05
TPSA96.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.45
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[(5-fluoro-2-methoxyphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)propanamide?
The IUPAC name of 2-[(5-fluoro-2-methoxyphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)propanamide (CID 43890677) is 2-[(5-fluoro-2-methoxyphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)propanamide.
What is the SMILES notation for 2-[(5-fluoro-2-methoxyphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)propanamide?
The canonical SMILES for 2-[(5-fluoro-2-methoxyphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)propanamide is COc1ccc(F)cc1S(=O)(=O)NC(C)C(=O)NCCN1CCOCC1.
What is the InChIKey of 2-[(5-fluoro-2-methoxyphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)propanamide?
The InChIKey is FIDFSPBMGRTQLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FN3O5S/c1-12(16(21)18-5-6-20-7-9-25-10-8-20)19-26(22,23)15-11-13(17)3-4-14(15)24-2/h3-4,11-12,19H,5-10H2,1-2H3,(H,18,21).
What are the key properties of 2-[(5-fluoro-2-methoxyphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)propanamide?
2-[(5-fluoro-2-methoxyphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)propanamide has a molecular weight of 389.45 g/mol, XLogP of -0.05, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-fluoro-2-methoxyphenyl)sulfonylamino]-N-(2-morpholin-4-ylethyl)propanamide is sourced from PubChem (CID 43890677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).