1-cyclopentyl-N-[[(2R)-1-ethylpiperidin-2-yl]methyl]methanesulfonamide

C14H28N2O2S — CID 164639860

IUPAC1-cyclopentyl-N-[[(2R)-1-ethylpiperidin-2-yl]methyl]methanesulfonamide
SMILESCCN1CCCC[C@@H]1CNS(=O)(=O)CC1CCCC1
InChIInChI=1S/C14H28N2O2S/c1-2-16-10-6-5-9-14(16)11-15-19(17,18)12-13-7-3-4-8-13/h13-15H,2-12H2,1H3/t14-/m1/s1
InChIKeyBHICFHPYEBEYEQ-CQSZACIVSA-N
MW288.46 g/mol
LogP1.97
Rot. Bonds6

About 1-cyclopentyl-N-[[(2R)-1-ethylpiperidin-2-yl]methyl]methanesulfonamide

1-cyclopentyl-N-[[(2R)-1-ethylpiperidin-2-yl]methyl]methanesulfonamide (PubChem CID 164639860) has the molecular formula C14H28N2O2S and a molecular weight of 288.46 g/mol. Its IUPAC name is 1-cyclopentyl-N-[[(2R)-1-ethylpiperidin-2-yl]methyl]methanesulfonamide.

Molecular Properties

Compound Name1-cyclopentyl-N-[[(2R)-1-ethylpiperidin-2-yl]methyl]methanesulfonamide
PubChem CID164639860
Molecular FormulaC14H28N2O2S
Molecular Weight288.46 g/mol
Exact Mass288.19
IUPAC Name1-cyclopentyl-N-[[(2R)-1-ethylpiperidin-2-yl]methyl]methanesulfonamide
SMILESCCN1CCCC[C@@H]1CNS(=O)(=O)CC1CCCC1
InChIInChI=1S/C14H28N2O2S/c1-2-16-10-6-5-9-14(16)11-15-19(17,18)12-13-7-3-4-8-13/h13-15H,2-12H2,1H3/t14-/m1/s1
InChIKeyBHICFHPYEBEYEQ-CQSZACIVSA-N
XLogP1.97
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.46
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-[[(2R)-1-ethylpiperidin-2-yl]methyl]methanesulfonamide?
The IUPAC name of 1-cyclopentyl-N-[[(2R)-1-ethylpiperidin-2-yl]methyl]methanesulfonamide (CID 164639860) is 1-cyclopentyl-N-[[(2R)-1-ethylpiperidin-2-yl]methyl]methanesulfonamide.
What is the SMILES notation for 1-cyclopentyl-N-[[(2R)-1-ethylpiperidin-2-yl]methyl]methanesulfonamide?
The canonical SMILES for 1-cyclopentyl-N-[[(2R)-1-ethylpiperidin-2-yl]methyl]methanesulfonamide is CCN1CCCC[C@@H]1CNS(=O)(=O)CC1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-[[(2R)-1-ethylpiperidin-2-yl]methyl]methanesulfonamide?
The InChIKey is BHICFHPYEBEYEQ-CQSZACIVSA-N. The full InChI is InChI=1S/C14H28N2O2S/c1-2-16-10-6-5-9-14(16)11-15-19(17,18)12-13-7-3-4-8-13/h13-15H,2-12H2,1H3/t14-/m1/s1.
What are the key properties of 1-cyclopentyl-N-[[(2R)-1-ethylpiperidin-2-yl]methyl]methanesulfonamide?
1-cyclopentyl-N-[[(2R)-1-ethylpiperidin-2-yl]methyl]methanesulfonamide has a molecular weight of 288.46 g/mol, XLogP of 1.97, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-[[(2R)-1-ethylpiperidin-2-yl]methyl]methanesulfonamide is sourced from PubChem (CID 164639860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).