N-[(1-hydroxycyclopentyl)methyl]-N,2-dimethylpropane-2-sulfonamide

C11H23NO3S — CID 114951774

IUPACN-[(1-hydroxycyclopentyl)methyl]-N,2-dimethylpropane-2-sulfonamide
SMILESCN(CC1(O)CCCC1)S(=O)(=O)C(C)(C)C
InChIInChI=1S/C11H23NO3S/c1-10(2,3)16(14,15)12(4)9-11(13)7-5-6-8-11/h13H,5-9H2,1-4H3
InChIKeyRQXHWBFSBOVGPG-UHFFFAOYSA-N
MW249.38 g/mol
LogP1.35
Rot. Bonds3

About N-[(1-hydroxycyclopentyl)methyl]-N,2-dimethylpropane-2-sulfonamide

N-[(1-hydroxycyclopentyl)methyl]-N,2-dimethylpropane-2-sulfonamide (PubChem CID 114951774) has the molecular formula C11H23NO3S and a molecular weight of 249.38 g/mol. Its IUPAC name is N-[(1-hydroxycyclopentyl)methyl]-N,2-dimethylpropane-2-sulfonamide.

Molecular Properties

Compound NameN-[(1-hydroxycyclopentyl)methyl]-N,2-dimethylpropane-2-sulfonamide
PubChem CID114951774
Molecular FormulaC11H23NO3S
Molecular Weight249.38 g/mol
Exact Mass249.14
IUPAC NameN-[(1-hydroxycyclopentyl)methyl]-N,2-dimethylpropane-2-sulfonamide
SMILESCN(CC1(O)CCCC1)S(=O)(=O)C(C)(C)C
InChIInChI=1S/C11H23NO3S/c1-10(2,3)16(14,15)12(4)9-11(13)7-5-6-8-11/h13H,5-9H2,1-4H3
InChIKeyRQXHWBFSBOVGPG-UHFFFAOYSA-N
XLogP1.35
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-fluoro-N-[(1-hydroxycyclopentyl)methyl]-N-methylpropane-1-sulfonamide
CID 75435990
1,1,1-trifluoro-N-[(1-hydroxycyclopentyl)methyl]-N-methylmethanesulfonamide
CID 114951758
1,1-difluoro-N-[(1-hydroxycyclopentyl)methyl]-N-methylmethanesulfonamide
CID 115867596
4,4,4-trifluoro-N-[(1-hydroxycyclopentyl)methyl]-N-methylbutane-1-sulfonamide
CID 115967751
N-[(1-hydroxycyclopentyl)methyl]-2-methylpropane-2-sulfonamide
CID 65112881
1-Tert-butylsulfonyl-3-propylazetidin-3-ol
CID 65928740
(E)-N-[(1-hydroxycyclopentyl)methyl]-N-methylbut-2-ene-1-sulfonamide
CID 75394735
1-[[[Butyl(methyl)sulfamoyl]-methylamino]methyl]cyclopentan-1-ol
CID 75436030
1-[[Methyl(2-propan-2-ylsulfonylethyl)amino]methyl]cyclopentan-1-ol
CID 103839087
1-bromo-N-[(1-hydroxycyclopentyl)methyl]-N-methylmethanesulfonamide
CID 104099496
1-[(4-Methyl-1,1-dioxo-1,2-thiazolidin-2-yl)methyl]cyclopentan-1-ol
CID 104549885
1-Cyclopentylsulfonyl-3-propylazetidin-3-ol
CID 105361297

Frequently Asked Questions

What is the IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-N,2-dimethylpropane-2-sulfonamide?
The IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-N,2-dimethylpropane-2-sulfonamide (CID 114951774) is N-[(1-hydroxycyclopentyl)methyl]-N,2-dimethylpropane-2-sulfonamide.
What is the SMILES notation for N-[(1-hydroxycyclopentyl)methyl]-N,2-dimethylpropane-2-sulfonamide?
The canonical SMILES for N-[(1-hydroxycyclopentyl)methyl]-N,2-dimethylpropane-2-sulfonamide is CN(CC1(O)CCCC1)S(=O)(=O)C(C)(C)C.
What is the InChIKey of N-[(1-hydroxycyclopentyl)methyl]-N,2-dimethylpropane-2-sulfonamide?
The InChIKey is RQXHWBFSBOVGPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3S/c1-10(2,3)16(14,15)12(4)9-11(13)7-5-6-8-11/h13H,5-9H2,1-4H3.
What are the key properties of N-[(1-hydroxycyclopentyl)methyl]-N,2-dimethylpropane-2-sulfonamide?
N-[(1-hydroxycyclopentyl)methyl]-N,2-dimethylpropane-2-sulfonamide has a molecular weight of 249.38 g/mol, XLogP of 1.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-hydroxycyclopentyl)methyl]-N,2-dimethylpropane-2-sulfonamide is sourced from PubChem (CID 114951774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).