N-[2-(methylsulfamoyl)ethyl]-1-propan-2-ylpiperidine-4-carboxamide

C12H25N3O3S — CID 131909816

IUPACN-[2-(methylsulfamoyl)ethyl]-1-propan-2-ylpiperidine-4-carboxamide
SMILESCNS(=O)(=O)CCNC(=O)C1CCN(C(C)C)CC1
InChIInChI=1S/C12H25N3O3S/c1-10(2)15-7-4-11(5-8-15)12(16)14-6-9-19(17,18)13-3/h10-11,13H,4-9H2,1-3H3,(H,14,16)
InChIKeyRMIPDYGLCXJOBF-UHFFFAOYSA-N
MW291.42 g/mol
LogP-0.23
Rot. Bonds6

About N-[2-(methylsulfamoyl)ethyl]-1-propan-2-ylpiperidine-4-carboxamide

N-[2-(methylsulfamoyl)ethyl]-1-propan-2-ylpiperidine-4-carboxamide (PubChem CID 131909816) has the molecular formula C12H25N3O3S and a molecular weight of 291.42 g/mol. Its IUPAC name is N-[2-(methylsulfamoyl)ethyl]-1-propan-2-ylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(methylsulfamoyl)ethyl]-1-propan-2-ylpiperidine-4-carboxamide
PubChem CID131909816
Molecular FormulaC12H25N3O3S
Molecular Weight291.42 g/mol
Exact Mass291.16
IUPAC NameN-[2-(methylsulfamoyl)ethyl]-1-propan-2-ylpiperidine-4-carboxamide
SMILESCNS(=O)(=O)CCNC(=O)C1CCN(C(C)C)CC1
InChIInChI=1S/C12H25N3O3S/c1-10(2)15-7-4-11(5-8-15)12(16)14-6-9-19(17,18)13-3/h10-11,13H,4-9H2,1-3H3,(H,14,16)
InChIKeyRMIPDYGLCXJOBF-UHFFFAOYSA-N
XLogP-0.23
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.42
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-butyl-1-propan-2-ylpiperidine-4-carboxamide;ethane
CID 169158864
N-(3-oxopropyl)-1-propan-2-ylpiperidine-4-carboxamide
CID 176985907
3-[2-(methylsulfamoyl)ethylcarbamoyl]cyclopentane-1-carboxylic acid
CID 114174954
ethane;1-(1-propan-2-ylpiperidin-4-yl)ethanone
CID 177135939
2-[2-(methylsulfamoyl)ethylcarbamoyl]cyclohexane-1-carboxylic acid
CID 106334704
N-(2-methylsulfonylethyl)cyclopropanecarboxamide
CID 61066556
N-tert-butyl-1-propan-2-ylpiperidine-4-carboxamide
CID 155453359
1-cyclohexyl-N-[2-(methylsulfamoyl)ethyl]-5-oxopyrrolidine-3-carboxamide
CID 110631722
N-[2-(methylsulfamoyl)ethyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-6-carboxamide
CID 154822643
N-(3-indazol-1-ylpropyl)-1-propan-2-ylpiperidine-4-carboxamide
CID 72845118
N-(1-propan-2-ylpiperidin-4-yl)cyclopropanecarboxamide
CID 25236585
(3R)-N-methyl-1-propan-2-ylpyrrolidine-3-carboxamide
CID 130272211

Frequently Asked Questions

What is the IUPAC name of N-[2-(methylsulfamoyl)ethyl]-1-propan-2-ylpiperidine-4-carboxamide?
The IUPAC name of N-[2-(methylsulfamoyl)ethyl]-1-propan-2-ylpiperidine-4-carboxamide (CID 131909816) is N-[2-(methylsulfamoyl)ethyl]-1-propan-2-ylpiperidine-4-carboxamide.
What is the SMILES notation for N-[2-(methylsulfamoyl)ethyl]-1-propan-2-ylpiperidine-4-carboxamide?
The canonical SMILES for N-[2-(methylsulfamoyl)ethyl]-1-propan-2-ylpiperidine-4-carboxamide is CNS(=O)(=O)CCNC(=O)C1CCN(C(C)C)CC1.
What is the InChIKey of N-[2-(methylsulfamoyl)ethyl]-1-propan-2-ylpiperidine-4-carboxamide?
The InChIKey is RMIPDYGLCXJOBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O3S/c1-10(2)15-7-4-11(5-8-15)12(16)14-6-9-19(17,18)13-3/h10-11,13H,4-9H2,1-3H3,(H,14,16).
What are the key properties of N-[2-(methylsulfamoyl)ethyl]-1-propan-2-ylpiperidine-4-carboxamide?
N-[2-(methylsulfamoyl)ethyl]-1-propan-2-ylpiperidine-4-carboxamide has a molecular weight of 291.42 g/mol, XLogP of -0.23, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methylsulfamoyl)ethyl]-1-propan-2-ylpiperidine-4-carboxamide is sourced from PubChem (CID 131909816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).