4-fluoro-1-propan-2-ylpiperidine-4-sulfonamide

C8H17FN2O2S — CID 126737674

IUPAC4-fluoro-1-propan-2-ylpiperidine-4-sulfonamide
SMILESCC(C)N1CCC(F)(S(N)(=O)=O)CC1
InChIInChI=1S/C8H17FN2O2S/c1-7(2)11-5-3-8(9,4-6-11)14(10,12)13/h7H,3-6H2,1-2H3,(H2,10,12,13)
InChIKeyINAZZMQZBICIPI-UHFFFAOYSA-N
MW224.30 g/mol
LogP0.44
Rot. Bonds2

About 4-fluoro-1-propan-2-ylpiperidine-4-sulfonamide

4-fluoro-1-propan-2-ylpiperidine-4-sulfonamide (PubChem CID 126737674) has the molecular formula C8H17FN2O2S and a molecular weight of 224.30 g/mol. Its IUPAC name is 4-fluoro-1-propan-2-ylpiperidine-4-sulfonamide.

Molecular Properties

Compound Name4-fluoro-1-propan-2-ylpiperidine-4-sulfonamide
PubChem CID126737674
Molecular FormulaC8H17FN2O2S
Molecular Weight224.30 g/mol
Exact Mass224.10
IUPAC Name4-fluoro-1-propan-2-ylpiperidine-4-sulfonamide
SMILESCC(C)N1CCC(F)(S(N)(=O)=O)CC1
InChIInChI=1S/C8H17FN2O2S/c1-7(2)11-5-3-8(9,4-6-11)14(10,12)13/h7H,3-6H2,1-2H3,(H2,10,12,13)
InChIKeyINAZZMQZBICIPI-UHFFFAOYSA-N
XLogP0.44
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-iodo-1-propan-2-ylpiperidin-4-amine
CID 155455763
4-hydroxy-1-propan-2-ylpiperidine-4-sulfonic acid
CID 103573992
1-(1-methylcyclopropyl)sulfonyl-4-propan-2-ylpiperazine
CID 126752890
ethane;4-methyl-1-propan-2-yl-N-propylpiperidin-4-amine
CID 170571754
(4S)-3,3-difluoro-8-propan-2-yl-8-azaspiro[4.5]decan-4-amine
CID 146477426
1,4-di(propan-2-yl)piperidin-4-amine
CID 167417701
4-fluoro-4-(methoxymethyl)-1-propan-2-ylpiperidine
CID 167239675
(4-methoxy-1-propan-2-ylpiperidin-4-yl)methanamine
CID 83907040
1-propan-2-yl-4-(sulfamoylamino)piperidine
CID 112684194
propan-2-one;6-propan-2-yl-6-azaspiro[2.5]octane
CID 170791695
ethane;7-propan-2-yl-2-oxa-7-azaspiro[3.5]nonane
CID 163266549
(4-methyl-1-propan-2-ylpiperidin-4-yl)phosphane
CID 175635218

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1-propan-2-ylpiperidine-4-sulfonamide?
The IUPAC name of 4-fluoro-1-propan-2-ylpiperidine-4-sulfonamide (CID 126737674) is 4-fluoro-1-propan-2-ylpiperidine-4-sulfonamide.
What is the SMILES notation for 4-fluoro-1-propan-2-ylpiperidine-4-sulfonamide?
The canonical SMILES for 4-fluoro-1-propan-2-ylpiperidine-4-sulfonamide is CC(C)N1CCC(F)(S(N)(=O)=O)CC1.
What is the InChIKey of 4-fluoro-1-propan-2-ylpiperidine-4-sulfonamide?
The InChIKey is INAZZMQZBICIPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17FN2O2S/c1-7(2)11-5-3-8(9,4-6-11)14(10,12)13/h7H,3-6H2,1-2H3,(H2,10,12,13).
What are the key properties of 4-fluoro-1-propan-2-ylpiperidine-4-sulfonamide?
4-fluoro-1-propan-2-ylpiperidine-4-sulfonamide has a molecular weight of 224.30 g/mol, XLogP of 0.44, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1-propan-2-ylpiperidine-4-sulfonamide is sourced from PubChem (CID 126737674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).