N-[2-(methylsulfamoyl)ethyl]-5-(trifluoromethyl)piperidine-2-carboxamide

C10H18F3N3O3S — CID 106339577

IUPACN-[2-(methylsulfamoyl)ethyl]-5-(trifluoromethyl)piperidine-2-carboxamide
SMILESCNS(=O)(=O)CCNC(=O)C1CCC(C(F)(F)F)CN1
InChIInChI=1S/C10H18F3N3O3S/c1-14-20(18,19)5-4-15-9(17)8-3-2-7(6-16-8)10(11,12)13/h7-8,14,16H,2-6H2,1H3,(H,15,17)
InChIKeyGVPREVQQANLFPN-UHFFFAOYSA-N
MW317.33 g/mol
LogP-0.42
Rot. Bonds5

About N-[2-(methylsulfamoyl)ethyl]-5-(trifluoromethyl)piperidine-2-carboxamide

N-[2-(methylsulfamoyl)ethyl]-5-(trifluoromethyl)piperidine-2-carboxamide (PubChem CID 106339577) has the molecular formula C10H18F3N3O3S and a molecular weight of 317.33 g/mol. Its IUPAC name is N-[2-(methylsulfamoyl)ethyl]-5-(trifluoromethyl)piperidine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(methylsulfamoyl)ethyl]-5-(trifluoromethyl)piperidine-2-carboxamide
PubChem CID106339577
Molecular FormulaC10H18F3N3O3S
Molecular Weight317.33 g/mol
Exact Mass317.10
IUPAC NameN-[2-(methylsulfamoyl)ethyl]-5-(trifluoromethyl)piperidine-2-carboxamide
SMILESCNS(=O)(=O)CCNC(=O)C1CCC(C(F)(F)F)CN1
InChIInChI=1S/C10H18F3N3O3S/c1-14-20(18,19)5-4-15-9(17)8-3-2-7(6-16-8)10(11,12)13/h7-8,14,16H,2-6H2,1H3,(H,15,17)
InChIKeyGVPREVQQANLFPN-UHFFFAOYSA-N
XLogP-0.42
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.33
LogP ≤ 5-0.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(methylsulfamoyl)ethyl]-5-(trifluoromethyl)piperidine-2-carboxamide?
The IUPAC name of N-[2-(methylsulfamoyl)ethyl]-5-(trifluoromethyl)piperidine-2-carboxamide (CID 106339577) is N-[2-(methylsulfamoyl)ethyl]-5-(trifluoromethyl)piperidine-2-carboxamide.
What is the SMILES notation for N-[2-(methylsulfamoyl)ethyl]-5-(trifluoromethyl)piperidine-2-carboxamide?
The canonical SMILES for N-[2-(methylsulfamoyl)ethyl]-5-(trifluoromethyl)piperidine-2-carboxamide is CNS(=O)(=O)CCNC(=O)C1CCC(C(F)(F)F)CN1.
What is the InChIKey of N-[2-(methylsulfamoyl)ethyl]-5-(trifluoromethyl)piperidine-2-carboxamide?
The InChIKey is GVPREVQQANLFPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3N3O3S/c1-14-20(18,19)5-4-15-9(17)8-3-2-7(6-16-8)10(11,12)13/h7-8,14,16H,2-6H2,1H3,(H,15,17).
What are the key properties of N-[2-(methylsulfamoyl)ethyl]-5-(trifluoromethyl)piperidine-2-carboxamide?
N-[2-(methylsulfamoyl)ethyl]-5-(trifluoromethyl)piperidine-2-carboxamide has a molecular weight of 317.33 g/mol, XLogP of -0.42, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methylsulfamoyl)ethyl]-5-(trifluoromethyl)piperidine-2-carboxamide is sourced from PubChem (CID 106339577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).