[2-(2-propylsulfonylethylamino)cyclopentyl]methanol

C11H23NO3S — CID 106360883

IUPAC[2-(2-propylsulfonylethylamino)cyclopentyl]methanol
SMILESCCCS(=O)(=O)CCNC1CCCC1CO
InChIInChI=1S/C11H23NO3S/c1-2-7-16(14,15)8-6-12-11-5-3-4-10(11)9-13/h10-13H,2-9H2,1H3
InChIKeyXNBJBVXLDGFLRK-UHFFFAOYSA-N
MW249.38 g/mol
LogP0.56
Rot. Bonds7

About [2-(2-propylsulfonylethylamino)cyclopentyl]methanol

[2-(2-propylsulfonylethylamino)cyclopentyl]methanol (PubChem CID 106360883) has the molecular formula C11H23NO3S and a molecular weight of 249.38 g/mol. Its IUPAC name is [2-(2-propylsulfonylethylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[2-(2-propylsulfonylethylamino)cyclopentyl]methanol
PubChem CID106360883
Molecular FormulaC11H23NO3S
Molecular Weight249.38 g/mol
Exact Mass249.14
IUPAC Name[2-(2-propylsulfonylethylamino)cyclopentyl]methanol
SMILESCCCS(=O)(=O)CCNC1CCCC1CO
InChIInChI=1S/C11H23NO3S/c1-2-7-16(14,15)8-6-12-11-5-3-4-10(11)9-13/h10-13H,2-9H2,1H3
InChIKeyXNBJBVXLDGFLRK-UHFFFAOYSA-N
XLogP0.56
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-(2-propylsulfonylethyl)cyclopentan-1-amine
CID 106723715
2-[[(1R,2S)-2-(hydroxymethyl)cyclopentyl]amino]ethanol
CID 131230127
[2-(propylsulfamoylamino)cyclopentyl]methanol
CID 106364586
[2-[2-(tert-butylamino)ethylamino]cyclopentyl]methanol
CID 106359409
[2-(2-ethylsulfanylethylamino)cyclopentyl]methanol
CID 104668665
[2-[2-(dimethylamino)ethylamino]cyclohexyl]methanol
CID 104934564
4-methyl-N-(2-propylsulfonylethyl)cyclohexan-1-amine
CID 103830760
N-[2-(hydroxymethyl)cyclopentyl]methanesulfonamide
CID 103697796
N-[(1S,2S)-2-(hydroxymethyl)cyclohexyl]ethanesulfonamide
CID 86708972
9-methyl-N-(2-propylsulfonylethyl)-9-azabicyclo[3.3.1]nonan-3-amine
CID 106723889
N-ethyl-3-[[(1R,2S)-2-(hydroxymethyl)cyclohexyl]amino]propanamide
CID 99611784
[2-(3,3-diethoxypropylamino)cyclopentyl]methanol
CID 114178624

Frequently Asked Questions

What is the IUPAC name of [2-(2-propylsulfonylethylamino)cyclopentyl]methanol?
The IUPAC name of [2-(2-propylsulfonylethylamino)cyclopentyl]methanol (CID 106360883) is [2-(2-propylsulfonylethylamino)cyclopentyl]methanol.
What is the SMILES notation for [2-(2-propylsulfonylethylamino)cyclopentyl]methanol?
The canonical SMILES for [2-(2-propylsulfonylethylamino)cyclopentyl]methanol is CCCS(=O)(=O)CCNC1CCCC1CO.
What is the InChIKey of [2-(2-propylsulfonylethylamino)cyclopentyl]methanol?
The InChIKey is XNBJBVXLDGFLRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3S/c1-2-7-16(14,15)8-6-12-11-5-3-4-10(11)9-13/h10-13H,2-9H2,1H3.
What are the key properties of [2-(2-propylsulfonylethylamino)cyclopentyl]methanol?
[2-(2-propylsulfonylethylamino)cyclopentyl]methanol has a molecular weight of 249.38 g/mol, XLogP of 0.56, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-propylsulfonylethylamino)cyclopentyl]methanol is sourced from PubChem (CID 106360883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).