N-(2-methylpropylsulfamoyl)-6-(trifluoromethyl)piperidin-3-amine

C10H20F3N3O2S — CID 114815039

IUPACN-(2-methylpropylsulfamoyl)-6-(trifluoromethyl)piperidin-3-amine
SMILESCC(C)CNS(=O)(=O)NC1CCC(C(F)(F)F)NC1
InChIInChI=1S/C10H20F3N3O2S/c1-7(2)5-15-19(17,18)16-8-3-4-9(14-6-8)10(11,12)13/h7-9,14-16H,3-6H2,1-2H3
InChIKeyQFFUBUDEDOHFFQ-UHFFFAOYSA-N
MW303.35 g/mol
LogP0.75
Rot. Bonds5

About N-(2-methylpropylsulfamoyl)-6-(trifluoromethyl)piperidin-3-amine

N-(2-methylpropylsulfamoyl)-6-(trifluoromethyl)piperidin-3-amine (PubChem CID 114815039) has the molecular formula C10H20F3N3O2S and a molecular weight of 303.35 g/mol. Its IUPAC name is N-(2-methylpropylsulfamoyl)-6-(trifluoromethyl)piperidin-3-amine.

Molecular Properties

Compound NameN-(2-methylpropylsulfamoyl)-6-(trifluoromethyl)piperidin-3-amine
PubChem CID114815039
Molecular FormulaC10H20F3N3O2S
Molecular Weight303.35 g/mol
Exact Mass303.12
IUPAC NameN-(2-methylpropylsulfamoyl)-6-(trifluoromethyl)piperidin-3-amine
SMILESCC(C)CNS(=O)(=O)NC1CCC(C(F)(F)F)NC1
InChIInChI=1S/C10H20F3N3O2S/c1-7(2)5-15-19(17,18)16-8-3-4-9(14-6-8)10(11,12)13/h7-9,14-16H,3-6H2,1-2H3
InChIKeyQFFUBUDEDOHFFQ-UHFFFAOYSA-N
XLogP0.75
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.35
LogP ≤ 50.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1,1-difluoro-N-[6-(trifluoromethyl)piperidin-3-yl]methanesulfonamide
CID 82816995
1-N-methyl-4-N-(2-methylpropylsulfamoyl)cyclohexane-1,4-diamine
CID 114814968
(3R)-N-(2-methylpropylsulfamoyl)piperidin-3-amine
CID 104978718
N-[6-(trifluoromethyl)piperidin-3-yl]butane-1-sulfonamide
CID 82812636
2-ethoxy-N-[6-(trifluoromethyl)piperidin-3-yl]ethanesulfonamide
CID 82817082
2-ethyl-N-[6-(trifluoromethyl)piperidin-3-yl]-1H-imidazole-5-sulfonamide
CID 82794529
2-methoxy-N-[6-(trifluoromethyl)piperidin-3-yl]propanamide
CID 113374757
1-N-(cyclopropylsulfamoyl)-2-N-methylpropane-1,2-diamine
CID 103512559
3,3-dimethyl-N-(2-methylpropylsulfamoyl)cyclopentan-1-amine
CID 114814941
1-N-(cyclopropylsulfamoyl)-3-methylbutane-1,2-diamine
CID 114810889
1-(cyclopropylsulfamoylamino)-2,4-dimethylpentan-2-ol
CID 114809675
4,4,4-trifluoro-N-[6-(trifluoromethyl)piperidin-3-yl]butanamide
CID 82811943

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropylsulfamoyl)-6-(trifluoromethyl)piperidin-3-amine?
The IUPAC name of N-(2-methylpropylsulfamoyl)-6-(trifluoromethyl)piperidin-3-amine (CID 114815039) is N-(2-methylpropylsulfamoyl)-6-(trifluoromethyl)piperidin-3-amine.
What is the SMILES notation for N-(2-methylpropylsulfamoyl)-6-(trifluoromethyl)piperidin-3-amine?
The canonical SMILES for N-(2-methylpropylsulfamoyl)-6-(trifluoromethyl)piperidin-3-amine is CC(C)CNS(=O)(=O)NC1CCC(C(F)(F)F)NC1.
What is the InChIKey of N-(2-methylpropylsulfamoyl)-6-(trifluoromethyl)piperidin-3-amine?
The InChIKey is QFFUBUDEDOHFFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20F3N3O2S/c1-7(2)5-15-19(17,18)16-8-3-4-9(14-6-8)10(11,12)13/h7-9,14-16H,3-6H2,1-2H3.
What are the key properties of N-(2-methylpropylsulfamoyl)-6-(trifluoromethyl)piperidin-3-amine?
N-(2-methylpropylsulfamoyl)-6-(trifluoromethyl)piperidin-3-amine has a molecular weight of 303.35 g/mol, XLogP of 0.75, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropylsulfamoyl)-6-(trifluoromethyl)piperidin-3-amine is sourced from PubChem (CID 114815039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).