N-[4-[(4-fluorophenyl)sulfonylamino]-2,5-dimethoxyphenyl]acetamide

C16H17FN2O5S — CID 1362037

IUPACN-[4-[(4-fluorophenyl)sulfonylamino]-2,5-dimethoxyphenyl]acetamide
SMILESCOc1cc(NS(=O)(=O)c2ccc(F)cc2)c(OC)cc1NC(C)=O
InChIInChI=1S/C16H17FN2O5S/c1-10(20)18-13-8-16(24-3)14(9-15(13)23-2)19-25(21,22)12-6-4-11(17)5-7-12/h4-9,19H,1-3H3,(H,18,20)
InChIKeyVRISSQZIYAXRDW-UHFFFAOYSA-N
MW368.39 g/mol
LogP2.60
Rot. Bonds6

About N-[4-[(4-fluorophenyl)sulfonylamino]-2,5-dimethoxyphenyl]acetamide

N-[4-[(4-fluorophenyl)sulfonylamino]-2,5-dimethoxyphenyl]acetamide (PubChem CID 1362037) has the molecular formula C16H17FN2O5S and a molecular weight of 368.39 g/mol. Its IUPAC name is N-[4-[(4-fluorophenyl)sulfonylamino]-2,5-dimethoxyphenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(4-fluorophenyl)sulfonylamino]-2,5-dimethoxyphenyl]acetamide
PubChem CID1362037
Molecular FormulaC16H17FN2O5S
Molecular Weight368.39 g/mol
Exact Mass368.08
IUPAC NameN-[4-[(4-fluorophenyl)sulfonylamino]-2,5-dimethoxyphenyl]acetamide
SMILESCOc1cc(NS(=O)(=O)c2ccc(F)cc2)c(OC)cc1NC(C)=O
InChIInChI=1S/C16H17FN2O5S/c1-10(20)18-13-8-16(24-3)14(9-15(13)23-2)19-25(21,22)12-6-4-11(17)5-7-12/h4-9,19H,1-3H3,(H,18,20)
InChIKeyVRISSQZIYAXRDW-UHFFFAOYSA-N
XLogP2.60
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.39
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-fluorophenyl)sulfonylamino]-2,5-dimethoxyphenyl]acetamide?
The IUPAC name of N-[4-[(4-fluorophenyl)sulfonylamino]-2,5-dimethoxyphenyl]acetamide (CID 1362037) is N-[4-[(4-fluorophenyl)sulfonylamino]-2,5-dimethoxyphenyl]acetamide.
What is the SMILES notation for N-[4-[(4-fluorophenyl)sulfonylamino]-2,5-dimethoxyphenyl]acetamide?
The canonical SMILES for N-[4-[(4-fluorophenyl)sulfonylamino]-2,5-dimethoxyphenyl]acetamide is COc1cc(NS(=O)(=O)c2ccc(F)cc2)c(OC)cc1NC(C)=O.
What is the InChIKey of N-[4-[(4-fluorophenyl)sulfonylamino]-2,5-dimethoxyphenyl]acetamide?
The InChIKey is VRISSQZIYAXRDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O5S/c1-10(20)18-13-8-16(24-3)14(9-15(13)23-2)19-25(21,22)12-6-4-11(17)5-7-12/h4-9,19H,1-3H3,(H,18,20).
What are the key properties of N-[4-[(4-fluorophenyl)sulfonylamino]-2,5-dimethoxyphenyl]acetamide?
N-[4-[(4-fluorophenyl)sulfonylamino]-2,5-dimethoxyphenyl]acetamide has a molecular weight of 368.39 g/mol, XLogP of 2.60, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4-fluorophenyl)sulfonylamino]-2,5-dimethoxyphenyl]acetamide is sourced from PubChem (CID 1362037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).