N-(2-amino-1-cyclopentylethyl)-3-fluoropyridine-2-sulfonamide

C12H18FN3O2S — CID 106737928

IUPACN-(2-amino-1-cyclopentylethyl)-3-fluoropyridine-2-sulfonamide
SMILESNCC(NS(=O)(=O)c1ncccc1F)C1CCCC1
InChIInChI=1S/C12H18FN3O2S/c13-10-6-3-7-15-12(10)19(17,18)16-11(8-14)9-4-1-2-5-9/h3,6-7,9,11,16H,1-2,4-5,8,14H2
InChIKeyGHYKFANQAQCHGE-UHFFFAOYSA-N
MW287.36 g/mol
LogP1.02
Rot. Bonds5

About N-(2-amino-1-cyclopentylethyl)-3-fluoropyridine-2-sulfonamide

N-(2-amino-1-cyclopentylethyl)-3-fluoropyridine-2-sulfonamide (PubChem CID 106737928) has the molecular formula C12H18FN3O2S and a molecular weight of 287.36 g/mol. Its IUPAC name is N-(2-amino-1-cyclopentylethyl)-3-fluoropyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopentylethyl)-3-fluoropyridine-2-sulfonamide
PubChem CID106737928
Molecular FormulaC12H18FN3O2S
Molecular Weight287.36 g/mol
Exact Mass287.11
IUPAC NameN-(2-amino-1-cyclopentylethyl)-3-fluoropyridine-2-sulfonamide
SMILESNCC(NS(=O)(=O)c1ncccc1F)C1CCCC1
InChIInChI=1S/C12H18FN3O2S/c13-10-6-3-7-15-12(10)19(17,18)16-11(8-14)9-4-1-2-5-9/h3,6-7,9,11,16H,1-2,4-5,8,14H2
InChIKeyGHYKFANQAQCHGE-UHFFFAOYSA-N
XLogP1.02
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(Trifluoromethyl)pyridine-2-sulfonamide
CID 13910921
4-fluoro-N-(2-pyridin-4-ylethyl)benzenesulfonamide
CID 688002
3-{1-[(4-Fluorophenyl)sulfonyl]-2-pyrrolidinyl}pyridine
CID 2738275
3,4-difluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide
CID 2473445
4-fluoro-N-[2-(4-methylpiperazin-1-yl)-2-pyridin-3-ylethyl]benzenesulfonamide
CID 3238186
trans-N-(4-((R)-1-amino-2-(2,5-difluorophenyl)ethyl)cyclohexyl)-N-methylpyridine-3-sulfonamide
CID 53318856
2-methyl-N-[[4-(2-pyrrolidin-1-ylsulfonyl-3-pyridinyl)phenyl]methyl]propan-1-amine
CID 53465638
4-Fluoro-3-methyl-N-pyridin-3-ylmethyl-benzenesulfonamide
CID 849940
N-[2-(dimethylamino)-2-pyridin-3-ylethyl]-4-methylbenzenesulfonamide
CID 3237497
N-(2-(4-ethylpiperazin-1-yl)-2-(pyridin-3-yl)ethyl)-4-fluorobenzenesulfonamide
CID 16806769
3-Methylpyridine-2-sulfonamide
CID 12295469
3-Fluoropyridine-2-sulfonamide
CID 19957930

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopentylethyl)-3-fluoropyridine-2-sulfonamide?
The IUPAC name of N-(2-amino-1-cyclopentylethyl)-3-fluoropyridine-2-sulfonamide (CID 106737928) is N-(2-amino-1-cyclopentylethyl)-3-fluoropyridine-2-sulfonamide.
What is the SMILES notation for N-(2-amino-1-cyclopentylethyl)-3-fluoropyridine-2-sulfonamide?
The canonical SMILES for N-(2-amino-1-cyclopentylethyl)-3-fluoropyridine-2-sulfonamide is NCC(NS(=O)(=O)c1ncccc1F)C1CCCC1.
What is the InChIKey of N-(2-amino-1-cyclopentylethyl)-3-fluoropyridine-2-sulfonamide?
The InChIKey is GHYKFANQAQCHGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18FN3O2S/c13-10-6-3-7-15-12(10)19(17,18)16-11(8-14)9-4-1-2-5-9/h3,6-7,9,11,16H,1-2,4-5,8,14H2.
What are the key properties of N-(2-amino-1-cyclopentylethyl)-3-fluoropyridine-2-sulfonamide?
N-(2-amino-1-cyclopentylethyl)-3-fluoropyridine-2-sulfonamide has a molecular weight of 287.36 g/mol, XLogP of 1.02, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopentylethyl)-3-fluoropyridine-2-sulfonamide is sourced from PubChem (CID 106737928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).