furan-2-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone

C14H21N3O4S — CID 5298740

IUPACfuran-2-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone
SMILESO=C(c1ccco1)N1CCN(S(=O)(=O)N2CCCCC2)CC1
InChIInChI=1S/C14H21N3O4S/c18-14(13-5-4-12-21-13)15-8-10-17(11-9-15)22(19,20)16-6-2-1-3-7-16/h4-5,12H,1-3,6-11H2
InChIKeyPHDMNRHYAYLXFR-UHFFFAOYSA-N
MW327.41 g/mol
LogP0.77
Rot. Bonds3

About furan-2-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone

furan-2-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone (PubChem CID 5298740) has the molecular formula C14H21N3O4S and a molecular weight of 327.41 g/mol. Its IUPAC name is furan-2-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone.

Molecular Properties

Compound Namefuran-2-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone
PubChem CID5298740
Molecular FormulaC14H21N3O4S
Molecular Weight327.41 g/mol
Exact Mass327.13
IUPAC Namefuran-2-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone
SMILESO=C(c1ccco1)N1CCN(S(=O)(=O)N2CCCCC2)CC1
InChIInChI=1S/C14H21N3O4S/c18-14(13-5-4-12-21-13)15-8-10-17(11-9-15)22(19,20)16-6-2-1-3-7-16/h4-5,12H,1-3,6-11H2
InChIKeyPHDMNRHYAYLXFR-UHFFFAOYSA-N
XLogP0.77
TPSA74.07 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.41
LogP ≤ 50.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze furan-2-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone 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

azepan-1-yl(furan-2-yl)methanone
CID 5200992
[4-(4-tert-butylpiperidin-1-yl)sulfonylpiperazin-1-yl]-(furan-2-yl)methanone
CID 71907901
1-[4-(furan-2-carbonyl)piperazin-1-yl]-3-piperidin-1-ylsulfonylpropan-1-one
CID 110342641
cyclobutyl-[4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]piperidin-1-yl]methanone
CID 113005207
1-[4-(furan-2-carbonyl)piperazin-1-yl]-2,2-dimethyl-3-pyrrolidin-1-ylpropane-1,3-dione
CID 108958407
[4-[6-(azepan-1-yl)pyridazin-3-yl]piperazin-1-yl]-(furan-2-yl)methanone
CID 7292456
2-[4-(furan-2-carbonyl)piperazin-1-yl]-1-piperidin-1-ylethanone
CID 1452094
1-(azepan-1-yl)-2-[4-(furan-2-carbonyl)piperazin-1-yl]ethanone
CID 78789970
furan-2-yl-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone
CID 756358
N-benzyl-4-(furan-2-carbonyl)-N-methyl-1,4-diazepane-1-sulfonamide
CID 131918040
3-(azepan-1-yl)-1-[4-(furan-2-carbonyl)piperazin-1-yl]propan-1-one
CID 109030070
furan-2-yl-[4-[(3-methylphenyl)methylsulfonyl]-1,4-diazepan-1-yl]methanone
CID 110798091

Frequently Asked Questions

What is the IUPAC name of furan-2-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone?
The IUPAC name of furan-2-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone (CID 5298740) is furan-2-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone.
What is the SMILES notation for furan-2-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone?
The canonical SMILES for furan-2-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone is O=C(c1ccco1)N1CCN(S(=O)(=O)N2CCCCC2)CC1.
What is the InChIKey of furan-2-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone?
The InChIKey is PHDMNRHYAYLXFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O4S/c18-14(13-5-4-12-21-13)15-8-10-17(11-9-15)22(19,20)16-6-2-1-3-7-16/h4-5,12H,1-3,6-11H2.
What are the key properties of furan-2-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone?
furan-2-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone has a molecular weight of 327.41 g/mol, XLogP of 0.77, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-(4-piperidin-1-ylsulfonylpiperazin-1-yl)methanone is sourced from PubChem (CID 5298740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).