N-(2-piperidin-1-ylethyl)-N-propan-2-ylmethanesulfonamide

C11H24N2O2S — CID 58659540

IUPACN-(2-piperidin-1-ylethyl)-N-propan-2-ylmethanesulfonamide
SMILESCC(C)N(CCN1CCCCC1)S(C)(=O)=O
InChIInChI=1S/C11H24N2O2S/c1-11(2)13(16(3,14)15)10-9-12-7-5-4-6-8-12/h11H,4-10H2,1-3H3
InChIKeyUYFHPJRKNSRDQD-UHFFFAOYSA-N
MW248.39 g/mol
LogP1.14
Rot. Bonds5

About N-(2-piperidin-1-ylethyl)-N-propan-2-ylmethanesulfonamide

N-(2-piperidin-1-ylethyl)-N-propan-2-ylmethanesulfonamide (PubChem CID 58659540) has the molecular formula C11H24N2O2S and a molecular weight of 248.39 g/mol. Its IUPAC name is N-(2-piperidin-1-ylethyl)-N-propan-2-ylmethanesulfonamide.

Molecular Properties

Compound NameN-(2-piperidin-1-ylethyl)-N-propan-2-ylmethanesulfonamide
PubChem CID58659540
Molecular FormulaC11H24N2O2S
Molecular Weight248.39 g/mol
Exact Mass248.16
IUPAC NameN-(2-piperidin-1-ylethyl)-N-propan-2-ylmethanesulfonamide
SMILESCC(C)N(CCN1CCCCC1)S(C)(=O)=O
InChIInChI=1S/C11H24N2O2S/c1-11(2)13(16(3,14)15)10-9-12-7-5-4-6-8-12/h11H,4-10H2,1-3H3
InChIKeyUYFHPJRKNSRDQD-UHFFFAOYSA-N
XLogP1.14
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.39
LogP ≤ 51.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-1-ylethyl)-N-propan-2-ylmethanesulfonamide?
The IUPAC name of N-(2-piperidin-1-ylethyl)-N-propan-2-ylmethanesulfonamide (CID 58659540) is N-(2-piperidin-1-ylethyl)-N-propan-2-ylmethanesulfonamide.
What is the SMILES notation for N-(2-piperidin-1-ylethyl)-N-propan-2-ylmethanesulfonamide?
The canonical SMILES for N-(2-piperidin-1-ylethyl)-N-propan-2-ylmethanesulfonamide is CC(C)N(CCN1CCCCC1)S(C)(=O)=O.
What is the InChIKey of N-(2-piperidin-1-ylethyl)-N-propan-2-ylmethanesulfonamide?
The InChIKey is UYFHPJRKNSRDQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2S/c1-11(2)13(16(3,14)15)10-9-12-7-5-4-6-8-12/h11H,4-10H2,1-3H3.
What are the key properties of N-(2-piperidin-1-ylethyl)-N-propan-2-ylmethanesulfonamide?
N-(2-piperidin-1-ylethyl)-N-propan-2-ylmethanesulfonamide has a molecular weight of 248.39 g/mol, XLogP of 1.14, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-1-ylethyl)-N-propan-2-ylmethanesulfonamide is sourced from PubChem (CID 58659540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).