N-[(2-hydroxycyclopentyl)methyl]-N-methyl-1-(1,2-oxazol-3-yl)methanesulfonamide

C11H18N2O4S — CID 109396018

IUPACN-[(2-hydroxycyclopentyl)methyl]-N-methyl-1-(1,2-oxazol-3-yl)methanesulfonamide
SMILESCN(CC1CCCC1O)S(=O)(=O)Cc1ccon1
InChIInChI=1S/C11H18N2O4S/c1-13(7-9-3-2-4-11(9)14)18(15,16)8-10-5-6-17-12-10/h5-6,9,11,14H,2-4,7-8H2,1H3
InChIKeyFXNICCUECXZURH-UHFFFAOYSA-N
MW274.34 g/mol
LogP0.60
Rot. Bonds5

About N-[(2-hydroxycyclopentyl)methyl]-N-methyl-1-(1,2-oxazol-3-yl)methanesulfonamide

N-[(2-hydroxycyclopentyl)methyl]-N-methyl-1-(1,2-oxazol-3-yl)methanesulfonamide (PubChem CID 109396018) has the molecular formula C11H18N2O4S and a molecular weight of 274.34 g/mol. Its IUPAC name is N-[(2-hydroxycyclopentyl)methyl]-N-methyl-1-(1,2-oxazol-3-yl)methanesulfonamide.

Molecular Properties

Compound NameN-[(2-hydroxycyclopentyl)methyl]-N-methyl-1-(1,2-oxazol-3-yl)methanesulfonamide
PubChem CID109396018
Molecular FormulaC11H18N2O4S
Molecular Weight274.34 g/mol
Exact Mass274.10
IUPAC NameN-[(2-hydroxycyclopentyl)methyl]-N-methyl-1-(1,2-oxazol-3-yl)methanesulfonamide
SMILESCN(CC1CCCC1O)S(=O)(=O)Cc1ccon1
InChIInChI=1S/C11H18N2O4S/c1-13(7-9-3-2-4-11(9)14)18(15,16)8-10-5-6-17-12-10/h5-6,9,11,14H,2-4,7-8H2,1H3
InChIKeyFXNICCUECXZURH-UHFFFAOYSA-N
XLogP0.60
TPSA83.64 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-hydroxy-4-methylpentan-2-yl)-1-(1,2-oxazol-3-yl)methanesulfonamide
CID 75387049
N-[(2-hydroxycyclopentyl)methyl]-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
CID 65833506
3-[[4-(3-Cyclopentylpropyl)piperazin-1-yl]sulfonylmethyl]-1,2-oxazole
CID 71971941
3-[[4-(2-Cyclopentylethyl)piperazin-1-yl]sulfonylmethyl]-1,2-oxazole
CID 71988750
3-[[4-(Cyclopentylmethyl)piperazin-1-yl]sulfonylmethyl]-1,2-oxazole
CID 71988752
2-[1-[(5-Methyl-1,2-oxazol-3-yl)methylsulfonyl]pyrrolidin-2-yl]cyclopentan-1-ol
CID 79539675
N-[(2-hydroxycyclopentyl)methyl]-1-(1,2-oxazol-3-yl)methanesulfonamide
CID 109616846
2-[1-(1,2-Oxazol-3-ylmethylsulfonyl)pyrrolidin-2-yl]propan-2-ol
CID 109874807
N-(2-hydroxy-2-methylpropyl)-N-methyl-1-(1,2-oxazol-3-yl)methanesulfonamide
CID 109895552
N-ethyl-N-(2-hydroxy-2-methylpropyl)-1-(1,2-oxazol-3-yl)methanesulfonamide
CID 109895613
[4-Ethyl-1-(1,2-oxazol-3-ylmethylsulfonyl)piperidin-4-yl]methanol
CID 109896489
4-Methyl-1-(1,2-oxazol-3-ylmethylsulfonyl)piperidin-3-ol
CID 109948507

Frequently Asked Questions

What is the IUPAC name of N-[(2-hydroxycyclopentyl)methyl]-N-methyl-1-(1,2-oxazol-3-yl)methanesulfonamide?
The IUPAC name of N-[(2-hydroxycyclopentyl)methyl]-N-methyl-1-(1,2-oxazol-3-yl)methanesulfonamide (CID 109396018) is N-[(2-hydroxycyclopentyl)methyl]-N-methyl-1-(1,2-oxazol-3-yl)methanesulfonamide.
What is the SMILES notation for N-[(2-hydroxycyclopentyl)methyl]-N-methyl-1-(1,2-oxazol-3-yl)methanesulfonamide?
The canonical SMILES for N-[(2-hydroxycyclopentyl)methyl]-N-methyl-1-(1,2-oxazol-3-yl)methanesulfonamide is CN(CC1CCCC1O)S(=O)(=O)Cc1ccon1.
What is the InChIKey of N-[(2-hydroxycyclopentyl)methyl]-N-methyl-1-(1,2-oxazol-3-yl)methanesulfonamide?
The InChIKey is FXNICCUECXZURH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O4S/c1-13(7-9-3-2-4-11(9)14)18(15,16)8-10-5-6-17-12-10/h5-6,9,11,14H,2-4,7-8H2,1H3.
What are the key properties of N-[(2-hydroxycyclopentyl)methyl]-N-methyl-1-(1,2-oxazol-3-yl)methanesulfonamide?
N-[(2-hydroxycyclopentyl)methyl]-N-methyl-1-(1,2-oxazol-3-yl)methanesulfonamide has a molecular weight of 274.34 g/mol, XLogP of 0.60, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-hydroxycyclopentyl)methyl]-N-methyl-1-(1,2-oxazol-3-yl)methanesulfonamide is sourced from PubChem (CID 109396018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).