N-cyclopropyl-N-(piperidin-3-ylmethyl)methanesulfonamide

C10H20N2O2S — CID 106631170

IUPACN-cyclopropyl-N-(piperidin-3-ylmethyl)methanesulfonamide
SMILESCS(=O)(=O)N(CC1CCCNC1)C1CC1
InChIInChI=1S/C10H20N2O2S/c1-15(13,14)12(10-4-5-10)8-9-3-2-6-11-7-9/h9-11H,2-8H2,1H3
InChIKeyOXGSTWPKSHPXEX-UHFFFAOYSA-N
MW232.35 g/mol
LogP0.41
Rot. Bonds4

About N-cyclopropyl-N-(piperidin-3-ylmethyl)methanesulfonamide

N-cyclopropyl-N-(piperidin-3-ylmethyl)methanesulfonamide (PubChem CID 106631170) has the molecular formula C10H20N2O2S and a molecular weight of 232.35 g/mol. Its IUPAC name is N-cyclopropyl-N-(piperidin-3-ylmethyl)methanesulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(piperidin-3-ylmethyl)methanesulfonamide
PubChem CID106631170
Molecular FormulaC10H20N2O2S
Molecular Weight232.35 g/mol
Exact Mass232.12
IUPAC NameN-cyclopropyl-N-(piperidin-3-ylmethyl)methanesulfonamide
SMILESCS(=O)(=O)N(CC1CCCNC1)C1CC1
InChIInChI=1S/C10H20N2O2S/c1-15(13,14)12(10-4-5-10)8-9-3-2-6-11-7-9/h9-11H,2-8H2,1H3
InChIKeyOXGSTWPKSHPXEX-UHFFFAOYSA-N
XLogP0.41
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(piperidin-3-ylmethyl)methanesulfonamide?
The IUPAC name of N-cyclopropyl-N-(piperidin-3-ylmethyl)methanesulfonamide (CID 106631170) is N-cyclopropyl-N-(piperidin-3-ylmethyl)methanesulfonamide.
What is the SMILES notation for N-cyclopropyl-N-(piperidin-3-ylmethyl)methanesulfonamide?
The canonical SMILES for N-cyclopropyl-N-(piperidin-3-ylmethyl)methanesulfonamide is CS(=O)(=O)N(CC1CCCNC1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(piperidin-3-ylmethyl)methanesulfonamide?
The InChIKey is OXGSTWPKSHPXEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2S/c1-15(13,14)12(10-4-5-10)8-9-3-2-6-11-7-9/h9-11H,2-8H2,1H3.
What are the key properties of N-cyclopropyl-N-(piperidin-3-ylmethyl)methanesulfonamide?
N-cyclopropyl-N-(piperidin-3-ylmethyl)methanesulfonamide has a molecular weight of 232.35 g/mol, XLogP of 0.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(piperidin-3-ylmethyl)methanesulfonamide is sourced from PubChem (CID 106631170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).