N-[(3-methoxycyclobutyl)methyl]ethenesulfonamide

C8H15NO3S — CID 167884934

IUPACN-[(3-methoxycyclobutyl)methyl]ethenesulfonamide
SMILESC=CS(=O)(=O)NCC1CC(OC)C1
InChIInChI=1S/C8H15NO3S/c1-3-13(10,11)9-6-7-4-8(5-7)12-2/h3,7-9H,1,4-6H2,2H3
InChIKeyOYPUWUIUVGHVTJ-UHFFFAOYSA-N
MW205.28 g/mol
LogP0.47
Rot. Bonds5

About N-[(3-methoxycyclobutyl)methyl]ethenesulfonamide

N-[(3-methoxycyclobutyl)methyl]ethenesulfonamide (PubChem CID 167884934) has the molecular formula C8H15NO3S and a molecular weight of 205.28 g/mol. Its IUPAC name is N-[(3-methoxycyclobutyl)methyl]ethenesulfonamide.

Molecular Properties

Compound NameN-[(3-methoxycyclobutyl)methyl]ethenesulfonamide
PubChem CID167884934
Molecular FormulaC8H15NO3S
Molecular Weight205.28 g/mol
Exact Mass205.08
IUPAC NameN-[(3-methoxycyclobutyl)methyl]ethenesulfonamide
SMILESC=CS(=O)(=O)NCC1CC(OC)C1
InChIInChI=1S/C8H15NO3S/c1-3-13(10,11)9-6-7-4-8(5-7)12-2/h3,7-9H,1,4-6H2,2H3
InChIKeyOYPUWUIUVGHVTJ-UHFFFAOYSA-N
XLogP0.47
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.28
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[(3S)-1-acetylpyrrolidin-3-yl]methyl]ethenesulfonamide
CID 146211914
N-[(3-methoxycyclobutyl)methyl]-2-methylpropan-2-amine
CID 106824564
N-[[(3R)-1-[(2-methoxy-2,3-dihydro-1H-inden-5-yl)sulfonyl]pyrrolidin-3-yl]methyl]ethenesulfonamide
CID 146211986
N-[[(3S)-1-ethylpyrrolidin-3-yl]methyl]ethenesulfonamide
CID 146211909
N-[[(3S)-1-(3-methoxyphenyl)sulfonylpyrrolidin-3-yl]methyl]ethenesulfonamide
CID 146211982
N-[[(3R)-1-(3-methoxyphenyl)sulfonylpyrrolidin-3-yl]methyl]ethenesulfonamide
CID 146211401
N-[[(3S)-1-(3,5-dimethylbenzoyl)pyrrolidin-3-yl]methyl]ethenesulfonamide
CID 146210524
N-[[(3S)-1-[(2-fluoro-4-methoxyphenyl)methyl]pyrrolidin-3-yl]methyl]ethenesulfonamide
CID 146210587
1-(chloromethyl)-3-methoxycyclobutane
CID 106824609
N-[[1-(1-methylpyrrole-2-carbonyl)pyrrolidin-3-yl]methyl]ethenesulfonamide
CID 146210419
N-[[1-[4-(dimethylamino)benzoyl]pyrrolidin-3-yl]methyl]ethenesulfonamide
CID 146211753
1-cyclopropyl-N-(methylsulfamoyl)methanamine
CID 130639656

Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxycyclobutyl)methyl]ethenesulfonamide?
The IUPAC name of N-[(3-methoxycyclobutyl)methyl]ethenesulfonamide (CID 167884934) is N-[(3-methoxycyclobutyl)methyl]ethenesulfonamide.
What is the SMILES notation for N-[(3-methoxycyclobutyl)methyl]ethenesulfonamide?
The canonical SMILES for N-[(3-methoxycyclobutyl)methyl]ethenesulfonamide is C=CS(=O)(=O)NCC1CC(OC)C1.
What is the InChIKey of N-[(3-methoxycyclobutyl)methyl]ethenesulfonamide?
The InChIKey is OYPUWUIUVGHVTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO3S/c1-3-13(10,11)9-6-7-4-8(5-7)12-2/h3,7-9H,1,4-6H2,2H3.
What are the key properties of N-[(3-methoxycyclobutyl)methyl]ethenesulfonamide?
N-[(3-methoxycyclobutyl)methyl]ethenesulfonamide has a molecular weight of 205.28 g/mol, XLogP of 0.47, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxycyclobutyl)methyl]ethenesulfonamide is sourced from PubChem (CID 167884934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).