3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclopentan-1-amine

C8H16F3N3O2S — CID 106125410

IUPAC3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclopentan-1-amine
SMILESNC1CCC(CNS(=O)(=O)NCC(F)(F)F)C1
InChIInChI=1S/C8H16F3N3O2S/c9-8(10,11)5-14-17(15,16)13-4-6-1-2-7(12)3-6/h6-7,13-14H,1-5,12H2
InChIKeyDOUADXOJNJZMIW-UHFFFAOYSA-N
MW275.30 g/mol
LogP0.10
Rot. Bonds5

About 3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclopentan-1-amine

3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclopentan-1-amine (PubChem CID 106125410) has the molecular formula C8H16F3N3O2S and a molecular weight of 275.30 g/mol. Its IUPAC name is 3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclopentan-1-amine.

Molecular Properties

Compound Name3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclopentan-1-amine
PubChem CID106125410
Molecular FormulaC8H16F3N3O2S
Molecular Weight275.30 g/mol
Exact Mass275.09
IUPAC Name3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclopentan-1-amine
SMILESNC1CCC(CNS(=O)(=O)NCC(F)(F)F)C1
InChIInChI=1S/C8H16F3N3O2S/c9-8(10,11)5-14-17(15,16)13-4-6-1-2-7(12)3-6/h6-7,13-14H,1-5,12H2
InChIKeyDOUADXOJNJZMIW-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

1,1,1-trifluoro-N-(3-methylcyclopentyl)methanesulfonamide
CID 14967680
N-[(3-aminocyclopentyl)methyl]-4,4,4-trifluorobutane-1-sulfonamide
CID 106125472
N-[(3-aminocyclopentyl)methyl]-1,1-difluoromethanesulfonamide
CID 106125546
3-[(2,2,2-Trifluoroethylsulfamoylamino)methyl]cyclohexan-1-amine
CID 106125994
4-[(2,2,2-Trifluoroethylsulfamoylamino)methyl]cyclohexan-1-amine
CID 106126247
N-(2-amino-1-cyclopentylethyl)-1,1-difluoromethanesulfonamide
CID 106737846
1-cyclopentyl-N-(2,2,2-trifluoroethylsulfamoyl)ethane-1,2-diamine
CID 106737872
2-(2,2,2-Trifluoroethylsulfamoylamino)cyclopentane-1-carbonitrile
CID 113637036
1-(Aminomethyl)-2-[methyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclopentane
CID 113637411
2-propyl-N-(2,2,2-trifluoroethylsulfamoyl)butane-1,4-diamine
CID 114145477
1-(aminomethyl)-N-(2,2,2-trifluoroethylsulfamoyl)cyclopentan-1-amine
CID 114803341
2-(aminomethyl)-N-(2,2,2-trifluoroethylsulfamoyl)cyclopentan-1-amine
CID 114803980

Frequently Asked Questions

What is the IUPAC name of 3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclopentan-1-amine?
The IUPAC name of 3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclopentan-1-amine (CID 106125410) is 3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclopentan-1-amine.
What is the SMILES notation for 3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclopentan-1-amine?
The canonical SMILES for 3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclopentan-1-amine is NC1CCC(CNS(=O)(=O)NCC(F)(F)F)C1.
What is the InChIKey of 3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclopentan-1-amine?
The InChIKey is DOUADXOJNJZMIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16F3N3O2S/c9-8(10,11)5-14-17(15,16)13-4-6-1-2-7(12)3-6/h6-7,13-14H,1-5,12H2.
What are the key properties of 3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclopentan-1-amine?
3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]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 3-[(2,2,2-trifluoroethylsulfamoylamino)methyl]cyclopentan-1-amine is sourced from PubChem (CID 106125410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).