N-(dicyclopropylmethyl)-1-piperidin-4-ylmethanesulfonamide

C13H24N2O2S — CID 54972712

IUPACN-(dicyclopropylmethyl)-1-piperidin-4-ylmethanesulfonamide
SMILESO=S(=O)(CC1CCNCC1)NC(C1CC1)C1CC1
InChIInChI=1S/C13H24N2O2S/c16-18(17,9-10-5-7-14-8-6-10)15-13(11-1-2-11)12-3-4-12/h10-15H,1-9H2
InChIKeyNMAVZYMSXNWEOZ-UHFFFAOYSA-N
MW272.41 g/mol
LogP1.09
Rot. Bonds6

About N-(dicyclopropylmethyl)-1-piperidin-4-ylmethanesulfonamide

N-(dicyclopropylmethyl)-1-piperidin-4-ylmethanesulfonamide (PubChem CID 54972712) has the molecular formula C13H24N2O2S and a molecular weight of 272.41 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-1-piperidin-4-ylmethanesulfonamide.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-1-piperidin-4-ylmethanesulfonamide
PubChem CID54972712
Molecular FormulaC13H24N2O2S
Molecular Weight272.41 g/mol
Exact Mass272.16
IUPAC NameN-(dicyclopropylmethyl)-1-piperidin-4-ylmethanesulfonamide
SMILESO=S(=O)(CC1CCNCC1)NC(C1CC1)C1CC1
InChIInChI=1S/C13H24N2O2S/c16-18(17,9-10-5-7-14-8-6-10)15-13(11-1-2-11)12-3-4-12/h10-15H,1-9H2
InChIKeyNMAVZYMSXNWEOZ-UHFFFAOYSA-N
XLogP1.09
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.41
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-1-piperidin-4-ylmethanesulfonamide?
The IUPAC name of N-(dicyclopropylmethyl)-1-piperidin-4-ylmethanesulfonamide (CID 54972712) is N-(dicyclopropylmethyl)-1-piperidin-4-ylmethanesulfonamide.
What is the SMILES notation for N-(dicyclopropylmethyl)-1-piperidin-4-ylmethanesulfonamide?
The canonical SMILES for N-(dicyclopropylmethyl)-1-piperidin-4-ylmethanesulfonamide is O=S(=O)(CC1CCNCC1)NC(C1CC1)C1CC1.
What is the InChIKey of N-(dicyclopropylmethyl)-1-piperidin-4-ylmethanesulfonamide?
The InChIKey is NMAVZYMSXNWEOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2S/c16-18(17,9-10-5-7-14-8-6-10)15-13(11-1-2-11)12-3-4-12/h10-15H,1-9H2.
What are the key properties of N-(dicyclopropylmethyl)-1-piperidin-4-ylmethanesulfonamide?
N-(dicyclopropylmethyl)-1-piperidin-4-ylmethanesulfonamide has a molecular weight of 272.41 g/mol, XLogP of 1.09, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-1-piperidin-4-ylmethanesulfonamide is sourced from PubChem (CID 54972712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).