N-(1-propan-2-ylpiperidin-3-yl)cyclopropanesulfonamide

C11H22N2O2S — CID 127905355

IUPACN-(1-propan-2-ylpiperidin-3-yl)cyclopropanesulfonamide
SMILESCC(C)N1CCCC(NS(=O)(=O)C2CC2)C1
InChIInChI=1S/C11H22N2O2S/c1-9(2)13-7-3-4-10(8-13)12-16(14,15)11-5-6-11/h9-12H,3-8H2,1-2H3
InChIKeyMDZRKVCOBJFWLY-UHFFFAOYSA-N
MW246.38 g/mol
LogP0.94
Rot. Bonds4

About N-(1-propan-2-ylpiperidin-3-yl)cyclopropanesulfonamide

N-(1-propan-2-ylpiperidin-3-yl)cyclopropanesulfonamide (PubChem CID 127905355) has the molecular formula C11H22N2O2S and a molecular weight of 246.38 g/mol. Its IUPAC name is N-(1-propan-2-ylpiperidin-3-yl)cyclopropanesulfonamide.

Molecular Properties

Compound NameN-(1-propan-2-ylpiperidin-3-yl)cyclopropanesulfonamide
PubChem CID127905355
Molecular FormulaC11H22N2O2S
Molecular Weight246.38 g/mol
Exact Mass246.14
IUPAC NameN-(1-propan-2-ylpiperidin-3-yl)cyclopropanesulfonamide
SMILESCC(C)N1CCCC(NS(=O)(=O)C2CC2)C1
InChIInChI=1S/C11H22N2O2S/c1-9(2)13-7-3-4-10(8-13)12-16(14,15)11-5-6-11/h9-12H,3-8H2,1-2H3
InChIKeyMDZRKVCOBJFWLY-UHFFFAOYSA-N
XLogP0.94
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.38
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-propan-2-ylpiperidin-3-yl)cyclopropanesulfonamide?
The IUPAC name of N-(1-propan-2-ylpiperidin-3-yl)cyclopropanesulfonamide (CID 127905355) is N-(1-propan-2-ylpiperidin-3-yl)cyclopropanesulfonamide.
What is the SMILES notation for N-(1-propan-2-ylpiperidin-3-yl)cyclopropanesulfonamide?
The canonical SMILES for N-(1-propan-2-ylpiperidin-3-yl)cyclopropanesulfonamide is CC(C)N1CCCC(NS(=O)(=O)C2CC2)C1.
What is the InChIKey of N-(1-propan-2-ylpiperidin-3-yl)cyclopropanesulfonamide?
The InChIKey is MDZRKVCOBJFWLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2S/c1-9(2)13-7-3-4-10(8-13)12-16(14,15)11-5-6-11/h9-12H,3-8H2,1-2H3.
What are the key properties of N-(1-propan-2-ylpiperidin-3-yl)cyclopropanesulfonamide?
N-(1-propan-2-ylpiperidin-3-yl)cyclopropanesulfonamide has a molecular weight of 246.38 g/mol, XLogP of 0.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-propan-2-ylpiperidin-3-yl)cyclopropanesulfonamide is sourced from PubChem (CID 127905355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).