N-(2,6-difluorophenyl)-2-[(4-methoxyphenyl)sulfonyl-methylamino]acetamide

C16H16F2N2O4S — CID 982324

IUPACN-(2,6-difluorophenyl)-2-[(4-methoxyphenyl)sulfonyl-methylamino]acetamide
SMILESCOc1ccc(S(=O)(=O)N(C)CC(=O)Nc2c(F)cccc2F)cc1
InChIInChI=1S/C16H16F2N2O4S/c1-20(25(22,23)12-8-6-11(24-2)7-9-12)10-15(21)19-16-13(17)4-3-5-14(16)18/h3-9H,10H2,1-2H3,(H,19,21)
InChIKeyFNRPACNUYHHHSO-UHFFFAOYSA-N
MW370.38 g/mol
LogP2.23
Rot. Bonds6

About N-(2,6-difluorophenyl)-2-[(4-methoxyphenyl)sulfonyl-methylamino]acetamide

N-(2,6-difluorophenyl)-2-[(4-methoxyphenyl)sulfonyl-methylamino]acetamide (PubChem CID 982324) has the molecular formula C16H16F2N2O4S and a molecular weight of 370.38 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)-2-[(4-methoxyphenyl)sulfonyl-methylamino]acetamide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)-2-[(4-methoxyphenyl)sulfonyl-methylamino]acetamide
PubChem CID982324
Molecular FormulaC16H16F2N2O4S
Molecular Weight370.38 g/mol
Exact Mass370.08
IUPAC NameN-(2,6-difluorophenyl)-2-[(4-methoxyphenyl)sulfonyl-methylamino]acetamide
SMILESCOc1ccc(S(=O)(=O)N(C)CC(=O)Nc2c(F)cccc2F)cc1
InChIInChI=1S/C16H16F2N2O4S/c1-20(25(22,23)12-8-6-11(24-2)7-9-12)10-15(21)19-16-13(17)4-3-5-14(16)18/h3-9H,10H2,1-2H3,(H,19,21)
InChIKeyFNRPACNUYHHHSO-UHFFFAOYSA-N
XLogP2.23
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.38
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)-2-[(4-methoxyphenyl)sulfonyl-methylamino]acetamide?
The IUPAC name of N-(2,6-difluorophenyl)-2-[(4-methoxyphenyl)sulfonyl-methylamino]acetamide (CID 982324) is N-(2,6-difluorophenyl)-2-[(4-methoxyphenyl)sulfonyl-methylamino]acetamide.
What is the SMILES notation for N-(2,6-difluorophenyl)-2-[(4-methoxyphenyl)sulfonyl-methylamino]acetamide?
The canonical SMILES for N-(2,6-difluorophenyl)-2-[(4-methoxyphenyl)sulfonyl-methylamino]acetamide is COc1ccc(S(=O)(=O)N(C)CC(=O)Nc2c(F)cccc2F)cc1.
What is the InChIKey of N-(2,6-difluorophenyl)-2-[(4-methoxyphenyl)sulfonyl-methylamino]acetamide?
The InChIKey is FNRPACNUYHHHSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F2N2O4S/c1-20(25(22,23)12-8-6-11(24-2)7-9-12)10-15(21)19-16-13(17)4-3-5-14(16)18/h3-9H,10H2,1-2H3,(H,19,21).
What are the key properties of N-(2,6-difluorophenyl)-2-[(4-methoxyphenyl)sulfonyl-methylamino]acetamide?
N-(2,6-difluorophenyl)-2-[(4-methoxyphenyl)sulfonyl-methylamino]acetamide has a molecular weight of 370.38 g/mol, XLogP of 2.23, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)-2-[(4-methoxyphenyl)sulfonyl-methylamino]acetamide is sourced from PubChem (CID 982324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).