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

C10H21FN2O2S — CID 120584859

IUPACN-(2-amino-1-cyclopentylethyl)-3-fluoropropane-1-sulfonamide
SMILESNCC(NS(=O)(=O)CCCF)C1CCCC1
InChIInChI=1S/C10H21FN2O2S/c11-6-3-7-16(14,15)13-10(8-12)9-4-1-2-5-9/h9-10,13H,1-8,12H2
InChIKeyYDZTUFZUDUBHJC-UHFFFAOYSA-N
MW252.35 g/mol
LogP0.78
Rot. Bonds7

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

N-(2-amino-1-cyclopentylethyl)-3-fluoropropane-1-sulfonamide (PubChem CID 120584859) has the molecular formula C10H21FN2O2S and a molecular weight of 252.35 g/mol. Its IUPAC name is N-(2-amino-1-cyclopentylethyl)-3-fluoropropane-1-sulfonamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopentylethyl)-3-fluoropropane-1-sulfonamide
PubChem CID120584859
Molecular FormulaC10H21FN2O2S
Molecular Weight252.35 g/mol
Exact Mass252.13
IUPAC NameN-(2-amino-1-cyclopentylethyl)-3-fluoropropane-1-sulfonamide
SMILESNCC(NS(=O)(=O)CCCF)C1CCCC1
InChIInChI=1S/C10H21FN2O2S/c11-6-3-7-16(14,15)13-10(8-12)9-4-1-2-5-9/h9-10,13H,1-8,12H2
InChIKeyYDZTUFZUDUBHJC-UHFFFAOYSA-N
XLogP0.78
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.35
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(aminomethyl)cyclopentyl]ethanesulfonamide
CID 28940534
(2S)-3-amino-3-cyclopentyl-2-fluoropropane-1-sulfonic acid
CID 11514107
(3S)-3-amino-3-cyclopentyl-2-fluoropropane-1-sulfonic acid
CID 11557641
(2R,3R)-3-amino-3-cyclopentyl-2-fluoropropane-1-sulfonic acid
CID 11644268
(3R)-3-amino-3-cyclopentyl-2-fluoropropane-1-sulfonic acid
CID 11658641
(2S,3R)-3-amino-3-cyclopentyl-2-fluoropropane-1-sulfonic acid
CID 11673036
(2S,3S)-3-amino-3-cyclopentyl-2-fluoropropane-1-sulfonic acid
CID 11680204
(2R)-3-amino-3-cyclopentyl-2-fluoropropane-1-sulfonic acid
CID 11687242
3-Amino-3-cyclopentyl-2-fluoropropane-1-sulfonic acid
CID 11708392
(2R,3S)-3-amino-3-cyclopentyl-2-fluoropropane-1-sulfonic acid
CID 58691999
3,3,3-trifluoro-N-[(1R,3S)-3-methylcyclopentyl]propane-1-sulfonamide
CID 68316105
N-[(1R,3S)-3-ethylcyclopentyl]-3-fluoropropane-1-sulfonamide
CID 70642520

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopentylethyl)-3-fluoropropane-1-sulfonamide?
The IUPAC name of N-(2-amino-1-cyclopentylethyl)-3-fluoropropane-1-sulfonamide (CID 120584859) is N-(2-amino-1-cyclopentylethyl)-3-fluoropropane-1-sulfonamide.
What is the SMILES notation for N-(2-amino-1-cyclopentylethyl)-3-fluoropropane-1-sulfonamide?
The canonical SMILES for N-(2-amino-1-cyclopentylethyl)-3-fluoropropane-1-sulfonamide is NCC(NS(=O)(=O)CCCF)C1CCCC1.
What is the InChIKey of N-(2-amino-1-cyclopentylethyl)-3-fluoropropane-1-sulfonamide?
The InChIKey is YDZTUFZUDUBHJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21FN2O2S/c11-6-3-7-16(14,15)13-10(8-12)9-4-1-2-5-9/h9-10,13H,1-8,12H2.
What are the key properties of N-(2-amino-1-cyclopentylethyl)-3-fluoropropane-1-sulfonamide?
N-(2-amino-1-cyclopentylethyl)-3-fluoropropane-1-sulfonamide has a molecular weight of 252.35 g/mol, XLogP of 0.78, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopentylethyl)-3-fluoropropane-1-sulfonamide is sourced from PubChem (CID 120584859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).