2-[2-(2-fluorophenyl)ethylsulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide

C14H16FN3O4S — CID 110619310

IUPAC2-[2-(2-fluorophenyl)ethylsulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCc1cc(NC(=O)CNS(=O)(=O)CCc2ccccc2F)no1
InChIInChI=1S/C14H16FN3O4S/c1-10-8-13(18-22-10)17-14(19)9-16-23(20,21)7-6-11-4-2-3-5-12(11)15/h2-5,8,16H,6-7,9H2,1H3,(H,17,18,19)
InChIKeyTXPJEXNFVARDPK-UHFFFAOYSA-N
MW341.36 g/mol
LogP1.22
Rot. Bonds7

About 2-[2-(2-fluorophenyl)ethylsulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide

2-[2-(2-fluorophenyl)ethylsulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide (PubChem CID 110619310) has the molecular formula C14H16FN3O4S and a molecular weight of 341.36 g/mol. Its IUPAC name is 2-[2-(2-fluorophenyl)ethylsulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound Name2-[2-(2-fluorophenyl)ethylsulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
PubChem CID110619310
Molecular FormulaC14H16FN3O4S
Molecular Weight341.36 g/mol
Exact Mass341.08
IUPAC Name2-[2-(2-fluorophenyl)ethylsulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCc1cc(NC(=O)CNS(=O)(=O)CCc2ccccc2F)no1
InChIInChI=1S/C14H16FN3O4S/c1-10-8-13(18-22-10)17-14(19)9-16-23(20,21)7-6-11-4-2-3-5-12(11)15/h2-5,8,16H,6-7,9H2,1H3,(H,17,18,19)
InChIKeyTXPJEXNFVARDPK-UHFFFAOYSA-N
XLogP1.22
TPSA101.30 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.36
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-(2-fluorophenyl)-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]propanamide
CID 110614533
2-(butylsulfonylamino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 110370271
N-(5-methyl-1,2-oxazol-3-yl)-3-(2-phenylethylsulfonylamino)propanamide
CID 110370442
(2-fluorophenyl)methyl-methyl-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]azanium
CID 9034400
N-cyclopropyl-2-[2-(2-fluorophenyl)ethylsulfonylamino]acetamide
CID 110305291
3-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 113121052
2-(2,6-difluoroanilino)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 109011324
2-[[2-(2-fluorophenoxy)acetyl]amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 110671924
3-[acetyl-[(2-fluorophenyl)methyl]amino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 113119233
2-[(4-chlorophenyl)sulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 110370274
N-[(2-fluorophenyl)methyl]-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide
CID 109020837
2-[3-[(2-fluorophenyl)methylamino]pyrazin-2-yl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 95919102

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-fluorophenyl)ethylsulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The IUPAC name of 2-[2-(2-fluorophenyl)ethylsulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide (CID 110619310) is 2-[2-(2-fluorophenyl)ethylsulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for 2-[2-(2-fluorophenyl)ethylsulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The canonical SMILES for 2-[2-(2-fluorophenyl)ethylsulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide is Cc1cc(NC(=O)CNS(=O)(=O)CCc2ccccc2F)no1.
What is the InChIKey of 2-[2-(2-fluorophenyl)ethylsulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The InChIKey is TXPJEXNFVARDPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3O4S/c1-10-8-13(18-22-10)17-14(19)9-16-23(20,21)7-6-11-4-2-3-5-12(11)15/h2-5,8,16H,6-7,9H2,1H3,(H,17,18,19).
What are the key properties of 2-[2-(2-fluorophenyl)ethylsulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
2-[2-(2-fluorophenyl)ethylsulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide has a molecular weight of 341.36 g/mol, XLogP of 1.22, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-fluorophenyl)ethylsulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 110619310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).