N-[(3-fluoropiperidin-3-yl)methyl]methanesulfonamide

C7H15FN2O2S — CID 130015323

IUPACN-[(3-fluoropiperidin-3-yl)methyl]methanesulfonamide
SMILESCS(=O)(=O)NCC1(F)CCCNC1
InChIInChI=1S/C7H15FN2O2S/c1-13(11,12)10-6-7(8)3-2-4-9-5-7/h9-10H,2-6H2,1H3
InChIKeyVMQNORHNXSELER-UHFFFAOYSA-N
MW210.27 g/mol
LogP-0.37
Rot. Bonds3

About N-[(3-fluoropiperidin-3-yl)methyl]methanesulfonamide

N-[(3-fluoropiperidin-3-yl)methyl]methanesulfonamide (PubChem CID 130015323) has the molecular formula C7H15FN2O2S and a molecular weight of 210.27 g/mol. Its IUPAC name is N-[(3-fluoropiperidin-3-yl)methyl]methanesulfonamide.

Molecular Properties

Compound NameN-[(3-fluoropiperidin-3-yl)methyl]methanesulfonamide
PubChem CID130015323
Molecular FormulaC7H15FN2O2S
Molecular Weight210.27 g/mol
Exact Mass210.08
IUPAC NameN-[(3-fluoropiperidin-3-yl)methyl]methanesulfonamide
SMILESCS(=O)(=O)NCC1(F)CCCNC1
InChIInChI=1S/C7H15FN2O2S/c1-13(11,12)10-6-7(8)3-2-4-9-5-7/h9-10H,2-6H2,1H3
InChIKeyVMQNORHNXSELER-UHFFFAOYSA-N
XLogP-0.37
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.27
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(piperidin-4-ylmethyl)methanesulfonamide
CID 5095908
N-(Piperidin-4-yl)methanesulfonamide
CID 16227261
N-(piperidin-3-ylmethyl)methanesulfonamide
CID 4343050
(3S,4R)-3-methyl-1-(methylsulfonyl)piperidin-4-amine
CID 98227926
N-[(3-fluoro-1-methylpiperidin-3-yl)methyl]methanesulfonamide
CID 59268340
1,1,1-trifluoro-N-(piperidin-3-ylmethyl)methanesulfonamide
CID 61791527
1-(Fluoromethylsulfonyl)piperidin-4-amine
CID 67402414
1,1,1-trifluoro-N-[[(3S)-piperidin-3-yl]methyl]methanesulfonamide
CID 68237974
1-fluoro-N-piperidin-4-ylmethanesulfonamide
CID 89020695
(4-Fluoro-1-methylsulfonylpiperidin-4-yl)methanamine
CID 118874537
N-[(4-fluoro-1-methylsulfonylpiperidin-4-yl)methyl]propan-2-amine
CID 121357714
N-[(4-fluoro-1-methylsulfonylpiperidin-4-yl)methyl]ethanamine
CID 121358961

Frequently Asked Questions

What is the IUPAC name of N-[(3-fluoropiperidin-3-yl)methyl]methanesulfonamide?
The IUPAC name of N-[(3-fluoropiperidin-3-yl)methyl]methanesulfonamide (CID 130015323) is N-[(3-fluoropiperidin-3-yl)methyl]methanesulfonamide.
What is the SMILES notation for N-[(3-fluoropiperidin-3-yl)methyl]methanesulfonamide?
The canonical SMILES for N-[(3-fluoropiperidin-3-yl)methyl]methanesulfonamide is CS(=O)(=O)NCC1(F)CCCNC1.
What is the InChIKey of N-[(3-fluoropiperidin-3-yl)methyl]methanesulfonamide?
The InChIKey is VMQNORHNXSELER-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15FN2O2S/c1-13(11,12)10-6-7(8)3-2-4-9-5-7/h9-10H,2-6H2,1H3.
What are the key properties of N-[(3-fluoropiperidin-3-yl)methyl]methanesulfonamide?
N-[(3-fluoropiperidin-3-yl)methyl]methanesulfonamide has a molecular weight of 210.27 g/mol, XLogP of -0.37, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-fluoropiperidin-3-yl)methyl]methanesulfonamide is sourced from PubChem (CID 130015323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).