N-[2-[2,2-difluoroethyl(methyl)amino]ethyl]-N-methylfuran-2-sulfonamide

C10H16F2N2O3S — CID 99802872

IUPACN-[2-[2,2-difluoroethyl(methyl)amino]ethyl]-N-methylfuran-2-sulfonamide
SMILESCN(CCN(C)S(=O)(=O)c1ccco1)CC(F)F
InChIInChI=1S/C10H16F2N2O3S/c1-13(8-9(11)12)5-6-14(2)18(15,16)10-4-3-7-17-10/h3-4,7,9H,5-6,8H2,1-2H3
InChIKeySBDCYPQRMKNNQD-UHFFFAOYSA-N
MW282.31 g/mol
LogP1.10
Rot. Bonds7

About N-[2-[2,2-difluoroethyl(methyl)amino]ethyl]-N-methylfuran-2-sulfonamide

N-[2-[2,2-difluoroethyl(methyl)amino]ethyl]-N-methylfuran-2-sulfonamide (PubChem CID 99802872) has the molecular formula C10H16F2N2O3S and a molecular weight of 282.31 g/mol. Its IUPAC name is N-[2-[2,2-difluoroethyl(methyl)amino]ethyl]-N-methylfuran-2-sulfonamide.

Molecular Properties

Compound NameN-[2-[2,2-difluoroethyl(methyl)amino]ethyl]-N-methylfuran-2-sulfonamide
PubChem CID99802872
Molecular FormulaC10H16F2N2O3S
Molecular Weight282.31 g/mol
Exact Mass282.08
IUPAC NameN-[2-[2,2-difluoroethyl(methyl)amino]ethyl]-N-methylfuran-2-sulfonamide
SMILESCN(CCN(C)S(=O)(=O)c1ccco1)CC(F)F
InChIInChI=1S/C10H16F2N2O3S/c1-13(8-9(11)12)5-6-14(2)18(15,16)10-4-3-7-17-10/h3-4,7,9H,5-6,8H2,1-2H3
InChIKeySBDCYPQRMKNNQD-UHFFFAOYSA-N
XLogP1.10
TPSA53.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.31
LogP ≤ 51.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[2-[2,2-difluoroethyl(methyl)amino]ethyl]-N-methylfuran-2-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-[2,2-difluoroethyl(methyl)amino]ethyl]-N-methylfuran-2-sulfonamide?
The IUPAC name of N-[2-[2,2-difluoroethyl(methyl)amino]ethyl]-N-methylfuran-2-sulfonamide (CID 99802872) is N-[2-[2,2-difluoroethyl(methyl)amino]ethyl]-N-methylfuran-2-sulfonamide.
What is the SMILES notation for N-[2-[2,2-difluoroethyl(methyl)amino]ethyl]-N-methylfuran-2-sulfonamide?
The canonical SMILES for N-[2-[2,2-difluoroethyl(methyl)amino]ethyl]-N-methylfuran-2-sulfonamide is CN(CCN(C)S(=O)(=O)c1ccco1)CC(F)F.
What is the InChIKey of N-[2-[2,2-difluoroethyl(methyl)amino]ethyl]-N-methylfuran-2-sulfonamide?
The InChIKey is SBDCYPQRMKNNQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F2N2O3S/c1-13(8-9(11)12)5-6-14(2)18(15,16)10-4-3-7-17-10/h3-4,7,9H,5-6,8H2,1-2H3.
What are the key properties of N-[2-[2,2-difluoroethyl(methyl)amino]ethyl]-N-methylfuran-2-sulfonamide?
N-[2-[2,2-difluoroethyl(methyl)amino]ethyl]-N-methylfuran-2-sulfonamide has a molecular weight of 282.31 g/mol, XLogP of 1.10, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2,2-difluoroethyl(methyl)amino]ethyl]-N-methylfuran-2-sulfonamide is sourced from PubChem (CID 99802872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).