2-(aminomethyl)-N-(2,2,2-trifluoroethylsulfamoyl)cyclopentan-1-amine

C8H16F3N3O2S — CID 114803980

IUPAC2-(aminomethyl)-N-(2,2,2-trifluoroethylsulfamoyl)cyclopentan-1-amine
SMILESNCC1CCCC1NS(=O)(=O)NCC(F)(F)F
InChIInChI=1S/C8H16F3N3O2S/c9-8(10,11)5-13-17(15,16)14-7-3-1-2-6(7)4-12/h6-7,13-14H,1-5,12H2
InChIKeySAIATPXRRWGHKD-UHFFFAOYSA-N
MW275.30 g/mol
LogP0.10
Rot. Bonds5

About 2-(aminomethyl)-N-(2,2,2-trifluoroethylsulfamoyl)cyclopentan-1-amine

2-(aminomethyl)-N-(2,2,2-trifluoroethylsulfamoyl)cyclopentan-1-amine (PubChem CID 114803980) has the molecular formula C8H16F3N3O2S and a molecular weight of 275.30 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(2,2,2-trifluoroethylsulfamoyl)cyclopentan-1-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-(2,2,2-trifluoroethylsulfamoyl)cyclopentan-1-amine
PubChem CID114803980
Molecular FormulaC8H16F3N3O2S
Molecular Weight275.30 g/mol
Exact Mass275.09
IUPAC Name2-(aminomethyl)-N-(2,2,2-trifluoroethylsulfamoyl)cyclopentan-1-amine
SMILESNCC1CCCC1NS(=O)(=O)NCC(F)(F)F
InChIInChI=1S/C8H16F3N3O2S/c9-8(10,11)5-13-17(15,16)14-7-3-1-2-6(7)4-12/h6-7,13-14H,1-5,12H2
InChIKeySAIATPXRRWGHKD-UHFFFAOYSA-N
XLogP0.10
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.30
LogP ≤ 50.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(aminomethyl)cyclopentyl]-1,1-difluoromethanesulfonamide
CID 62955345
N-[(2-aminocyclopentyl)methyl]-1,1-difluoromethanesulfonamide
CID 65838612
N-[2-(aminomethyl)cyclopentyl]-1,1,1-trifluoromethanesulfonamide
CID 65850775
N-[(2-aminocyclopentyl)methyl]-4,4,4-trifluorobutane-1-sulfonamide
CID 83058673
N-[2-(aminomethyl)cyclopentyl]-4,4,4-trifluorobutane-1-sulfonamide
CID 83068317
3-[(2,2,2-Trifluoroethylsulfamoylamino)methyl]cyclopentan-1-amine
CID 106125410
1-cyclopentyl-N-(2,2,2-trifluoroethylsulfamoyl)ethane-1,2-diamine
CID 106737872
2-(2,2,2-Trifluoroethylsulfamoylamino)cyclopentane-1-carbonitrile
CID 113637036
2-(2,2,2-Trifluoroethylsulfamoylamino)cyclopentane-1-carbothioamide
CID 113637096
1-(Aminomethyl)-2-[methyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclopentane
CID 113637411
4-methyl-3-N-(2,2,2-trifluoroethylsulfamoyl)pentane-1,3-diamine
CID 114178208
1-(aminomethyl)-N-(2,2,2-trifluoroethylsulfamoyl)cyclopentan-1-amine
CID 114803341

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-(2,2,2-trifluoroethylsulfamoyl)cyclopentan-1-amine?
The IUPAC name of 2-(aminomethyl)-N-(2,2,2-trifluoroethylsulfamoyl)cyclopentan-1-amine (CID 114803980) is 2-(aminomethyl)-N-(2,2,2-trifluoroethylsulfamoyl)cyclopentan-1-amine.
What is the SMILES notation for 2-(aminomethyl)-N-(2,2,2-trifluoroethylsulfamoyl)cyclopentan-1-amine?
The canonical SMILES for 2-(aminomethyl)-N-(2,2,2-trifluoroethylsulfamoyl)cyclopentan-1-amine is NCC1CCCC1NS(=O)(=O)NCC(F)(F)F.
What is the InChIKey of 2-(aminomethyl)-N-(2,2,2-trifluoroethylsulfamoyl)cyclopentan-1-amine?
The InChIKey is SAIATPXRRWGHKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16F3N3O2S/c9-8(10,11)5-13-17(15,16)14-7-3-1-2-6(7)4-12/h6-7,13-14H,1-5,12H2.
What are the key properties of 2-(aminomethyl)-N-(2,2,2-trifluoroethylsulfamoyl)cyclopentan-1-amine?
2-(aminomethyl)-N-(2,2,2-trifluoroethylsulfamoyl)cyclopentan-1-amine has a molecular weight of 275.30 g/mol, XLogP of 0.10, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(2,2,2-trifluoroethylsulfamoyl)cyclopentan-1-amine is sourced from PubChem (CID 114803980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).