5-fluoro-N-(pyrrolidin-3-ylmethyl)pyridine-3-sulfonamide

C10H14FN3O2S — CID 80563217

IUPAC5-fluoro-N-(pyrrolidin-3-ylmethyl)pyridine-3-sulfonamide
SMILESO=S(=O)(NCC1CCNC1)c1cncc(F)c1
InChIInChI=1S/C10H14FN3O2S/c11-9-3-10(7-13-6-9)17(15,16)14-5-8-1-2-12-4-8/h3,6-8,12,14H,1-2,4-5H2
InChIKeyKICYSWGDRZXWNS-UHFFFAOYSA-N
MW259.31 g/mol
LogP0.11
Rot. Bonds4

About 5-fluoro-N-(pyrrolidin-3-ylmethyl)pyridine-3-sulfonamide

5-fluoro-N-(pyrrolidin-3-ylmethyl)pyridine-3-sulfonamide (PubChem CID 80563217) has the molecular formula C10H14FN3O2S and a molecular weight of 259.31 g/mol. Its IUPAC name is 5-fluoro-N-(pyrrolidin-3-ylmethyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-fluoro-N-(pyrrolidin-3-ylmethyl)pyridine-3-sulfonamide
PubChem CID80563217
Molecular FormulaC10H14FN3O2S
Molecular Weight259.31 g/mol
Exact Mass259.08
IUPAC Name5-fluoro-N-(pyrrolidin-3-ylmethyl)pyridine-3-sulfonamide
SMILESO=S(=O)(NCC1CCNC1)c1cncc(F)c1
InChIInChI=1S/C10H14FN3O2S/c11-9-3-10(7-13-6-9)17(15,16)14-5-8-1-2-12-4-8/h3,6-8,12,14H,1-2,4-5H2
InChIKeyKICYSWGDRZXWNS-UHFFFAOYSA-N
XLogP0.11
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-bromocyclohexyl)methyl]-5-fluoropyridine-3-sulfonamide
CID 106136168
5-fluoro-N-[(3-hydroxycyclohexyl)methyl]pyridine-3-sulfonamide
CID 103835856
5-fluoro-N-[(3S)-piperidin-3-yl]pyridine-3-sulfonamide
CID 95400234
2-fluoro-5-methylsulfonyl-N-(pyrrolidin-3-ylmethyl)benzenesulfonamide
CID 80562570
4-methyl-N-(pyrrolidin-3-ylmethyl)benzenesulfonamide
CID 80563394
N-(pyrrolidin-3-ylmethyl)-1H-imidazole-5-sulfonamide;hydrochloride
CID 120721030
N-[2-(cyclopropylamino)ethyl]-5-fluoropyridine-3-sulfonamide
CID 62664626
3-cyano-4-fluoro-N-(pyrrolidin-3-ylmethyl)benzenesulfonamide;hydrochloride
CID 120720970
4-methoxy-N-(pyrrolidin-3-ylmethyl)benzenesulfonamide
CID 80563364
3-methoxy-N-(pyrrolidin-3-ylmethyl)benzenesulfonamide
CID 81259552
4-bromo-3-fluoro-N-(piperidin-3-ylmethyl)benzenesulfonamide;hydrochloride
CID 119968667
N-[[(3S)-pyrrolidin-3-yl]methyl]methanesulfonamide
CID 66653276

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-(pyrrolidin-3-ylmethyl)pyridine-3-sulfonamide?
The IUPAC name of 5-fluoro-N-(pyrrolidin-3-ylmethyl)pyridine-3-sulfonamide (CID 80563217) is 5-fluoro-N-(pyrrolidin-3-ylmethyl)pyridine-3-sulfonamide.
What is the SMILES notation for 5-fluoro-N-(pyrrolidin-3-ylmethyl)pyridine-3-sulfonamide?
The canonical SMILES for 5-fluoro-N-(pyrrolidin-3-ylmethyl)pyridine-3-sulfonamide is O=S(=O)(NCC1CCNC1)c1cncc(F)c1.
What is the InChIKey of 5-fluoro-N-(pyrrolidin-3-ylmethyl)pyridine-3-sulfonamide?
The InChIKey is KICYSWGDRZXWNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FN3O2S/c11-9-3-10(7-13-6-9)17(15,16)14-5-8-1-2-12-4-8/h3,6-8,12,14H,1-2,4-5H2.
What are the key properties of 5-fluoro-N-(pyrrolidin-3-ylmethyl)pyridine-3-sulfonamide?
5-fluoro-N-(pyrrolidin-3-ylmethyl)pyridine-3-sulfonamide has a molecular weight of 259.31 g/mol, XLogP of 0.11, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-(pyrrolidin-3-ylmethyl)pyridine-3-sulfonamide is sourced from PubChem (CID 80563217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).