1-(oxolan-2-yl)-N-(2-piperidin-3-ylethyl)methanesulfonamide

C12H24N2O3S — CID 55173540

IUPAC1-(oxolan-2-yl)-N-(2-piperidin-3-ylethyl)methanesulfonamide
SMILESO=S(=O)(CC1CCCO1)NCCC1CCCNC1
InChIInChI=1S/C12H24N2O3S/c15-18(16,10-12-4-2-8-17-12)14-7-5-11-3-1-6-13-9-11/h11-14H,1-10H2
InChIKeySFKWABZEBHZCBS-UHFFFAOYSA-N
MW276.40 g/mol
LogP0.47
Rot. Bonds6

About 1-(oxolan-2-yl)-N-(2-piperidin-3-ylethyl)methanesulfonamide

1-(oxolan-2-yl)-N-(2-piperidin-3-ylethyl)methanesulfonamide (PubChem CID 55173540) has the molecular formula C12H24N2O3S and a molecular weight of 276.40 g/mol. Its IUPAC name is 1-(oxolan-2-yl)-N-(2-piperidin-3-ylethyl)methanesulfonamide.

Molecular Properties

Compound Name1-(oxolan-2-yl)-N-(2-piperidin-3-ylethyl)methanesulfonamide
PubChem CID55173540
Molecular FormulaC12H24N2O3S
Molecular Weight276.40 g/mol
Exact Mass276.15
IUPAC Name1-(oxolan-2-yl)-N-(2-piperidin-3-ylethyl)methanesulfonamide
SMILESO=S(=O)(CC1CCCO1)NCCC1CCCNC1
InChIInChI=1S/C12H24N2O3S/c15-18(16,10-12-4-2-8-17-12)14-7-5-11-3-1-6-13-9-11/h11-14H,1-10H2
InChIKeySFKWABZEBHZCBS-UHFFFAOYSA-N
XLogP0.47
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.40
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-2-(oxolan-2-yl)ethanesulfonamide
CID 71969883
N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-sulfonamide
CID 94234671
1-(Oxolan-2-ylmethylsulfonyl)-4-propan-2-ylpiperidine
CID 127364587
3-methyl-N-[(3R)-1-oxa-8-azaspiro[4.5]decan-3-yl]butane-2-sulfonamide
CID 139462894
1-cyclopropyl-N-[(3R)-1-oxa-8-azaspiro[4.5]decan-3-yl]methanesulfonamide
CID 146311376
1-[(4R)-1-oxa-8-azaspiro[4.5]decan-4-yl]propane-2-sulfinamide
CID 156624819
N-(1-oxa-8-azaspiro[4.5]decan-3-yl)propane-2-sulfonamide
CID 163418620
N-(1-oxa-8-azaspiro[4.5]decan-3-yl)ethanesulfonamide
CID 166150809
N-(oxolan-2-ylmethyl)piperidine-3-sulfonamide
CID 24711155
N-[1-(oxolan-2-yl)ethyl]-1-piperidin-3-ylmethanesulfonamide
CID 54972025
N-[1-(oxolan-2-yl)ethyl]-1-piperidin-4-ylmethanesulfonamide
CID 54972026
N-methyl-N-(oxolan-2-ylmethyl)-1-piperidin-3-ylmethanesulfonamide
CID 54972397

Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-2-yl)-N-(2-piperidin-3-ylethyl)methanesulfonamide?
The IUPAC name of 1-(oxolan-2-yl)-N-(2-piperidin-3-ylethyl)methanesulfonamide (CID 55173540) is 1-(oxolan-2-yl)-N-(2-piperidin-3-ylethyl)methanesulfonamide.
What is the SMILES notation for 1-(oxolan-2-yl)-N-(2-piperidin-3-ylethyl)methanesulfonamide?
The canonical SMILES for 1-(oxolan-2-yl)-N-(2-piperidin-3-ylethyl)methanesulfonamide is O=S(=O)(CC1CCCO1)NCCC1CCCNC1.
What is the InChIKey of 1-(oxolan-2-yl)-N-(2-piperidin-3-ylethyl)methanesulfonamide?
The InChIKey is SFKWABZEBHZCBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3S/c15-18(16,10-12-4-2-8-17-12)14-7-5-11-3-1-6-13-9-11/h11-14H,1-10H2.
What are the key properties of 1-(oxolan-2-yl)-N-(2-piperidin-3-ylethyl)methanesulfonamide?
1-(oxolan-2-yl)-N-(2-piperidin-3-ylethyl)methanesulfonamide has a molecular weight of 276.40 g/mol, XLogP of 0.47, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-2-yl)-N-(2-piperidin-3-ylethyl)methanesulfonamide is sourced from PubChem (CID 55173540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).