N-[1-(furan-2-carbonyl)piperidin-4-yl]-1-phenylmethanesulfonamide

C17H20N2O4S — CID 110820123

IUPACN-[1-(furan-2-carbonyl)piperidin-4-yl]-1-phenylmethanesulfonamide
SMILESO=C(c1ccco1)N1CCC(NS(=O)(=O)Cc2ccccc2)CC1
InChIInChI=1S/C17H20N2O4S/c20-17(16-7-4-12-23-16)19-10-8-15(9-11-19)18-24(21,22)13-14-5-2-1-3-6-14/h1-7,12,15,18H,8-11,13H2
InChIKeyCUOOVDKZYAHREZ-UHFFFAOYSA-N
MW348.42 g/mol
LogP2.00
Rot. Bonds5

About N-[1-(furan-2-carbonyl)piperidin-4-yl]-1-phenylmethanesulfonamide

N-[1-(furan-2-carbonyl)piperidin-4-yl]-1-phenylmethanesulfonamide (PubChem CID 110820123) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is N-[1-(furan-2-carbonyl)piperidin-4-yl]-1-phenylmethanesulfonamide.

Molecular Properties

Compound NameN-[1-(furan-2-carbonyl)piperidin-4-yl]-1-phenylmethanesulfonamide
PubChem CID110820123
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC NameN-[1-(furan-2-carbonyl)piperidin-4-yl]-1-phenylmethanesulfonamide
SMILESO=C(c1ccco1)N1CCC(NS(=O)(=O)Cc2ccccc2)CC1
InChIInChI=1S/C17H20N2O4S/c20-17(16-7-4-12-23-16)19-10-8-15(9-11-19)18-24(21,22)13-14-5-2-1-3-6-14/h1-7,12,15,18H,8-11,13H2
InChIKeyCUOOVDKZYAHREZ-UHFFFAOYSA-N
XLogP2.00
TPSA79.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-phenyl-N-(1-propanoylpiperidin-4-yl)methanesulfonamide
CID 110819188
2-[[1-(furan-2-carbonyl)piperidin-4-yl]carbamoyl]benzoic acid
CID 113083174
[4-(cycloheptylamino)piperidin-1-yl]-(furan-2-yl)methanone
CID 71896264
1-(4-fluorophenyl)-N-[1-(furan-3-carbonyl)piperidin-4-yl]methanesulfonamide
CID 31817470
N-[1-(furan-2-carbonyl)piperidin-4-yl]-4-phenylmethoxybenzamide
CID 16606665
6-chloro-N-[1-(furan-2-carbonyl)piperidin-4-yl]pyridine-3-sulfonamide
CID 24627279
2-amino-N-[1-(furan-2-carbonyl)piperidin-4-yl]-2-phenylacetamide;hydrochloride
CID 119277094
methyl 4-[[1-(furan-2-carbonyl)piperidin-4-yl]amino]-4-oxobutanoate
CID 110820105
N-[1-(furan-2-carbonyl)piperidin-4-yl]-2-methyl-1,3-thiazole-5-sulfonamide
CID 71846455
N-[1-(furan-2-carbonyl)piperidin-4-yl]-3-(trifluoromethyl)benzenesulfonamide
CID 46656593
N-(1-cyclopentylpiperidin-4-yl)-1-phenylmethanesulfonamide
CID 110752104
2-[4-(benzylsulfonylamino)piperidin-1-yl]-N-phenylacetamide
CID 51335811

Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-carbonyl)piperidin-4-yl]-1-phenylmethanesulfonamide?
The IUPAC name of N-[1-(furan-2-carbonyl)piperidin-4-yl]-1-phenylmethanesulfonamide (CID 110820123) is N-[1-(furan-2-carbonyl)piperidin-4-yl]-1-phenylmethanesulfonamide.
What is the SMILES notation for N-[1-(furan-2-carbonyl)piperidin-4-yl]-1-phenylmethanesulfonamide?
The canonical SMILES for N-[1-(furan-2-carbonyl)piperidin-4-yl]-1-phenylmethanesulfonamide is O=C(c1ccco1)N1CCC(NS(=O)(=O)Cc2ccccc2)CC1.
What is the InChIKey of N-[1-(furan-2-carbonyl)piperidin-4-yl]-1-phenylmethanesulfonamide?
The InChIKey is CUOOVDKZYAHREZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c20-17(16-7-4-12-23-16)19-10-8-15(9-11-19)18-24(21,22)13-14-5-2-1-3-6-14/h1-7,12,15,18H,8-11,13H2.
What are the key properties of N-[1-(furan-2-carbonyl)piperidin-4-yl]-1-phenylmethanesulfonamide?
N-[1-(furan-2-carbonyl)piperidin-4-yl]-1-phenylmethanesulfonamide has a molecular weight of 348.42 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-carbonyl)piperidin-4-yl]-1-phenylmethanesulfonamide is sourced from PubChem (CID 110820123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).