1-(2,4-difluorophenyl)-N-[1-(furan-2-carbonyl)piperidin-3-yl]methanesulfonamide

C17H18F2N2O4S — CID 131914213

IUPAC1-(2,4-difluorophenyl)-N-[1-(furan-2-carbonyl)piperidin-3-yl]methanesulfonamide
SMILESO=C(c1ccco1)N1CCCC(NS(=O)(=O)Cc2ccc(F)cc2F)C1
InChIInChI=1S/C17H18F2N2O4S/c18-13-6-5-12(15(19)9-13)11-26(23,24)20-14-3-1-7-21(10-14)17(22)16-4-2-8-25-16/h2,4-6,8-9,14,20H,1,3,7,10-11H2
InChIKeyHMDUVVLJUPMEKI-UHFFFAOYSA-N
MW384.40 g/mol
LogP2.28
Rot. Bonds5

About 1-(2,4-difluorophenyl)-N-[1-(furan-2-carbonyl)piperidin-3-yl]methanesulfonamide

1-(2,4-difluorophenyl)-N-[1-(furan-2-carbonyl)piperidin-3-yl]methanesulfonamide (PubChem CID 131914213) has the molecular formula C17H18F2N2O4S and a molecular weight of 384.40 g/mol. Its IUPAC name is 1-(2,4-difluorophenyl)-N-[1-(furan-2-carbonyl)piperidin-3-yl]methanesulfonamide.

Molecular Properties

Compound Name1-(2,4-difluorophenyl)-N-[1-(furan-2-carbonyl)piperidin-3-yl]methanesulfonamide
PubChem CID131914213
Molecular FormulaC17H18F2N2O4S
Molecular Weight384.40 g/mol
Exact Mass384.10
IUPAC Name1-(2,4-difluorophenyl)-N-[1-(furan-2-carbonyl)piperidin-3-yl]methanesulfonamide
SMILESO=C(c1ccco1)N1CCCC(NS(=O)(=O)Cc2ccc(F)cc2F)C1
InChIInChI=1S/C17H18F2N2O4S/c18-13-6-5-12(15(19)9-13)11-26(23,24)20-14-3-1-7-21(10-14)17(22)16-4-2-8-25-16/h2,4-6,8-9,14,20H,1,3,7,10-11H2
InChIKeyHMDUVVLJUPMEKI-UHFFFAOYSA-N
XLogP2.28
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.40
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(2,4-difluorophenyl)-N-[1-(furan-2-carbonyl)piperidin-3-yl]methanesulfonamide with MolForge

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

Launch Full Analysis

Related Compounds

N-[1-(furan-2-carbonyl)piperidin-3-yl]azepane-1-sulfonamide
CID 131927041
N-[1-(furan-2-carbonyl)piperidin-4-yl]-1-phenylmethanesulfonamide
CID 110820123
[4-[(2,5-difluorophenyl)methylamino]piperidin-1-yl]-(furan-2-yl)methanone
CID 56814831
[(3R)-3-[(R)-(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]-(furan-2-yl)methanone
CID 126469323
tert-butyl (3R)-3-[(2-fluorophenyl)methylsulfonylamino]piperidine-1-carboxylate
CID 97171789
[3-[(4-fluorophenyl)methoxy]piperidin-1-yl]-(furan-2-yl)methanone
CID 42844110
furan-2-yl-[3-[[4-(methylamino)pyrimidin-2-yl]amino]piperidin-1-yl]methanone
CID 50962643
(3-chloropiperidin-1-yl)-(furan-2-yl)methanone
CID 63392823
[(3R)-3-[2-(2-fluorophenyl)ethyl]piperidin-1-yl]-(furan-2-yl)methanone
CID 42239830
N-[1-(furan-2-carbonyl)piperidin-3-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 131939712
[2-[(2,4-difluorophenoxy)methyl]morpholin-4-yl]-(furan-2-yl)methanone
CID 46041071
N-[1-(furan-2-carbonyl)piperidin-3-yl]-2-methyl-5-pyrazol-1-ylbenzenesulfonamide
CID 131948129

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-difluorophenyl)-N-[1-(furan-2-carbonyl)piperidin-3-yl]methanesulfonamide?
The IUPAC name of 1-(2,4-difluorophenyl)-N-[1-(furan-2-carbonyl)piperidin-3-yl]methanesulfonamide (CID 131914213) is 1-(2,4-difluorophenyl)-N-[1-(furan-2-carbonyl)piperidin-3-yl]methanesulfonamide.
What is the SMILES notation for 1-(2,4-difluorophenyl)-N-[1-(furan-2-carbonyl)piperidin-3-yl]methanesulfonamide?
The canonical SMILES for 1-(2,4-difluorophenyl)-N-[1-(furan-2-carbonyl)piperidin-3-yl]methanesulfonamide is O=C(c1ccco1)N1CCCC(NS(=O)(=O)Cc2ccc(F)cc2F)C1.
What is the InChIKey of 1-(2,4-difluorophenyl)-N-[1-(furan-2-carbonyl)piperidin-3-yl]methanesulfonamide?
The InChIKey is HMDUVVLJUPMEKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18F2N2O4S/c18-13-6-5-12(15(19)9-13)11-26(23,24)20-14-3-1-7-21(10-14)17(22)16-4-2-8-25-16/h2,4-6,8-9,14,20H,1,3,7,10-11H2.
What are the key properties of 1-(2,4-difluorophenyl)-N-[1-(furan-2-carbonyl)piperidin-3-yl]methanesulfonamide?
1-(2,4-difluorophenyl)-N-[1-(furan-2-carbonyl)piperidin-3-yl]methanesulfonamide has a molecular weight of 384.40 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-difluorophenyl)-N-[1-(furan-2-carbonyl)piperidin-3-yl]methanesulfonamide is sourced from PubChem (CID 131914213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).