2-amino-N-(2,4-difluorophenyl)-N-ethylethanesulfonamide

C10H14F2N2O2S — CID 28794316

IUPAC2-amino-N-(2,4-difluorophenyl)-N-ethylethanesulfonamide
SMILESCCN(c1ccc(F)cc1F)S(=O)(=O)CCN
InChIInChI=1S/C10H14F2N2O2S/c1-2-14(17(15,16)6-5-13)10-4-3-8(11)7-9(10)12/h3-4,7H,2,5-6,13H2,1H3
InChIKeyVCUSBGBURURWFR-UHFFFAOYSA-N
MW264.30 g/mol
LogP1.08
Rot. Bonds5

About 2-amino-N-(2,4-difluorophenyl)-N-ethylethanesulfonamide

2-amino-N-(2,4-difluorophenyl)-N-ethylethanesulfonamide (PubChem CID 28794316) has the molecular formula C10H14F2N2O2S and a molecular weight of 264.30 g/mol. Its IUPAC name is 2-amino-N-(2,4-difluorophenyl)-N-ethylethanesulfonamide.

Molecular Properties

Compound Name2-amino-N-(2,4-difluorophenyl)-N-ethylethanesulfonamide
PubChem CID28794316
Molecular FormulaC10H14F2N2O2S
Molecular Weight264.30 g/mol
Exact Mass264.07
IUPAC Name2-amino-N-(2,4-difluorophenyl)-N-ethylethanesulfonamide
SMILESCCN(c1ccc(F)cc1F)S(=O)(=O)CCN
InChIInChI=1S/C10H14F2N2O2S/c1-2-14(17(15,16)6-5-13)10-4-3-8(11)7-9(10)12/h3-4,7H,2,5-6,13H2,1H3
InChIKeyVCUSBGBURURWFR-UHFFFAOYSA-N
XLogP1.08
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.30
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,4-difluorophenyl)-N-ethylethanesulfonamide?
The IUPAC name of 2-amino-N-(2,4-difluorophenyl)-N-ethylethanesulfonamide (CID 28794316) is 2-amino-N-(2,4-difluorophenyl)-N-ethylethanesulfonamide.
What is the SMILES notation for 2-amino-N-(2,4-difluorophenyl)-N-ethylethanesulfonamide?
The canonical SMILES for 2-amino-N-(2,4-difluorophenyl)-N-ethylethanesulfonamide is CCN(c1ccc(F)cc1F)S(=O)(=O)CCN.
What is the InChIKey of 2-amino-N-(2,4-difluorophenyl)-N-ethylethanesulfonamide?
The InChIKey is VCUSBGBURURWFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F2N2O2S/c1-2-14(17(15,16)6-5-13)10-4-3-8(11)7-9(10)12/h3-4,7H,2,5-6,13H2,1H3.
What are the key properties of 2-amino-N-(2,4-difluorophenyl)-N-ethylethanesulfonamide?
2-amino-N-(2,4-difluorophenyl)-N-ethylethanesulfonamide has a molecular weight of 264.30 g/mol, XLogP of 1.08, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,4-difluorophenyl)-N-ethylethanesulfonamide is sourced from PubChem (CID 28794316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).