N-[(1-hydroxycyclopentyl)methyl]-N-methylpropane-2-sulfonamide

C10H21NO3S — CID 115867671

IUPACN-[(1-hydroxycyclopentyl)methyl]-N-methylpropane-2-sulfonamide
SMILESCC(C)S(=O)(=O)N(C)CC1(O)CCCC1
InChIInChI=1S/C10H21NO3S/c1-9(2)15(13,14)11(3)8-10(12)6-4-5-7-10/h9,12H,4-8H2,1-3H3
InChIKeyJJLSRKPTDJQYOB-UHFFFAOYSA-N
MW235.35 g/mol
LogP0.96
Rot. Bonds4

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

N-[(1-hydroxycyclopentyl)methyl]-N-methylpropane-2-sulfonamide (PubChem CID 115867671) has the molecular formula C10H21NO3S and a molecular weight of 235.35 g/mol. Its IUPAC name is N-[(1-hydroxycyclopentyl)methyl]-N-methylpropane-2-sulfonamide.

Molecular Properties

Compound NameN-[(1-hydroxycyclopentyl)methyl]-N-methylpropane-2-sulfonamide
PubChem CID115867671
Molecular FormulaC10H21NO3S
Molecular Weight235.35 g/mol
Exact Mass235.12
IUPAC NameN-[(1-hydroxycyclopentyl)methyl]-N-methylpropane-2-sulfonamide
SMILESCC(C)S(=O)(=O)N(C)CC1(O)CCCC1
InChIInChI=1S/C10H21NO3S/c1-9(2)15(13,14)11(3)8-10(12)6-4-5-7-10/h9,12H,4-8H2,1-3H3
InChIKeyJJLSRKPTDJQYOB-UHFFFAOYSA-N
XLogP0.96
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-hydroxycyclopentyl)methyl]-N-methylethanesulfonamide
CID 115867632
1-hydroxy-1-[[methyl(methylsulfamoyl)amino]methyl]cyclopentane
CID 114951771
3,3,3-trifluoro-N-[(1-hydroxycyclobutyl)methyl]-N,2-dimethylpropane-1-sulfonamide
CID 166308359
N-[(1-hydroxycyclopentyl)methyl]-N,4-dimethylpiperidine-1-sulfonamide
CID 115867678
N-[(1-hydroxycyclopentyl)methyl]-N-methyl-3-methylsulfonylpropanamide
CID 115760608
(2R)-2-amino-N-[(1-hydroxycyclopentyl)methyl]-N-methylpropanamide
CID 104985327
methyl 2-[(1-hydroxycyclopentyl)methyl-methylsulfamoyl]acetate
CID 115867674
2-[(1-hydroxycyclopentyl)methyl-methylamino]-N-propan-2-ylpropanamide
CID 115758694
1-[(dimethylamino)methyl]cycloheptan-1-ol
CID 104550048
ethyl 2-[(1-hydroxycyclopentyl)methyl-methylsulfamoyl]acetate
CID 115867673
1-[[2-methylpropyl(propan-2-yl)amino]methyl]cyclopentan-1-ol
CID 65212512
4-[(1-hydroxycyclopentyl)methyl-propan-2-ylamino]butanoic acid
CID 65212542

Frequently Asked Questions

What is the IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-N-methylpropane-2-sulfonamide?
The IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-N-methylpropane-2-sulfonamide (CID 115867671) is N-[(1-hydroxycyclopentyl)methyl]-N-methylpropane-2-sulfonamide.
What is the SMILES notation for N-[(1-hydroxycyclopentyl)methyl]-N-methylpropane-2-sulfonamide?
The canonical SMILES for N-[(1-hydroxycyclopentyl)methyl]-N-methylpropane-2-sulfonamide is CC(C)S(=O)(=O)N(C)CC1(O)CCCC1.
What is the InChIKey of N-[(1-hydroxycyclopentyl)methyl]-N-methylpropane-2-sulfonamide?
The InChIKey is JJLSRKPTDJQYOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO3S/c1-9(2)15(13,14)11(3)8-10(12)6-4-5-7-10/h9,12H,4-8H2,1-3H3.
What are the key properties of N-[(1-hydroxycyclopentyl)methyl]-N-methylpropane-2-sulfonamide?
N-[(1-hydroxycyclopentyl)methyl]-N-methylpropane-2-sulfonamide has a molecular weight of 235.35 g/mol, XLogP of 0.96, 4 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-methylpropane-2-sulfonamide is sourced from PubChem (CID 115867671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).