N-(2-methylhexan-2-yl)piperidine-1-sulfonamide

C12H26N2O2S — CID 138623370

IUPACN-(2-methylhexan-2-yl)piperidine-1-sulfonamide
SMILESCCCCC(C)(C)NS(=O)(=O)N1CCCCC1
InChIInChI=1S/C12H26N2O2S/c1-4-5-9-12(2,3)13-17(15,16)14-10-7-6-8-11-14/h13H,4-11H2,1-3H3
InChIKeyOWABCPJULLDIDI-UHFFFAOYSA-N
MW262.42 g/mol
LogP2.28
Rot. Bonds6

About N-(2-methylhexan-2-yl)piperidine-1-sulfonamide

N-(2-methylhexan-2-yl)piperidine-1-sulfonamide (PubChem CID 138623370) has the molecular formula C12H26N2O2S and a molecular weight of 262.42 g/mol. Its IUPAC name is N-(2-methylhexan-2-yl)piperidine-1-sulfonamide.

Molecular Properties

Compound NameN-(2-methylhexan-2-yl)piperidine-1-sulfonamide
PubChem CID138623370
Molecular FormulaC12H26N2O2S
Molecular Weight262.42 g/mol
Exact Mass262.17
IUPAC NameN-(2-methylhexan-2-yl)piperidine-1-sulfonamide
SMILESCCCCC(C)(C)NS(=O)(=O)N1CCCCC1
InChIInChI=1S/C12H26N2O2S/c1-4-5-9-12(2,3)13-17(15,16)14-10-7-6-8-11-14/h13H,4-11H2,1-3H3
InChIKeyOWABCPJULLDIDI-UHFFFAOYSA-N
XLogP2.28
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.42
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylhexan-2-yl)piperidine-1-sulfonamide?
The IUPAC name of N-(2-methylhexan-2-yl)piperidine-1-sulfonamide (CID 138623370) is N-(2-methylhexan-2-yl)piperidine-1-sulfonamide.
What is the SMILES notation for N-(2-methylhexan-2-yl)piperidine-1-sulfonamide?
The canonical SMILES for N-(2-methylhexan-2-yl)piperidine-1-sulfonamide is CCCCC(C)(C)NS(=O)(=O)N1CCCCC1.
What is the InChIKey of N-(2-methylhexan-2-yl)piperidine-1-sulfonamide?
The InChIKey is OWABCPJULLDIDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2S/c1-4-5-9-12(2,3)13-17(15,16)14-10-7-6-8-11-14/h13H,4-11H2,1-3H3.
What are the key properties of N-(2-methylhexan-2-yl)piperidine-1-sulfonamide?
N-(2-methylhexan-2-yl)piperidine-1-sulfonamide has a molecular weight of 262.42 g/mol, XLogP of 2.28, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylhexan-2-yl)piperidine-1-sulfonamide is sourced from PubChem (CID 138623370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).