2-[[butyl(methyl)sulfamoyl]amino]-4-hydroxy-1,1-dimethylcyclobutane

C11H24N2O3S — CID 114631521

IUPAC2-[[butyl(methyl)sulfamoyl]amino]-4-hydroxy-1,1-dimethylcyclobutane
SMILESCCCCN(C)S(=O)(=O)NC1CC(O)C1(C)C
InChIInChI=1S/C11H24N2O3S/c1-5-6-7-13(4)17(15,16)12-9-8-10(14)11(9,2)3/h9-10,12,14H,5-8H2,1-4H3
InChIKeyLQNXDNAUAOVHEH-UHFFFAOYSA-N
MW264.39 g/mol
LogP0.71
Rot. Bonds6

About 2-[[butyl(methyl)sulfamoyl]amino]-4-hydroxy-1,1-dimethylcyclobutane

2-[[butyl(methyl)sulfamoyl]amino]-4-hydroxy-1,1-dimethylcyclobutane (PubChem CID 114631521) has the molecular formula C11H24N2O3S and a molecular weight of 264.39 g/mol. Its IUPAC name is 2-[[butyl(methyl)sulfamoyl]amino]-4-hydroxy-1,1-dimethylcyclobutane.

Molecular Properties

Compound Name2-[[butyl(methyl)sulfamoyl]amino]-4-hydroxy-1,1-dimethylcyclobutane
PubChem CID114631521
Molecular FormulaC11H24N2O3S
Molecular Weight264.39 g/mol
Exact Mass264.15
IUPAC Name2-[[butyl(methyl)sulfamoyl]amino]-4-hydroxy-1,1-dimethylcyclobutane
SMILESCCCCN(C)S(=O)(=O)NC1CC(O)C1(C)C
InChIInChI=1S/C11H24N2O3S/c1-5-6-7-13(4)17(15,16)12-9-8-10(14)11(9,2)3/h9-10,12,14H,5-8H2,1-4H3
InChIKeyLQNXDNAUAOVHEH-UHFFFAOYSA-N
XLogP0.71
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N'-{[1-(hydroxymethyl)cyclobutyl]methyl}-N,N'-dimethylsulfamide
CID 129612989
2,2-Dimethyl-3-(2,2,2-trifluoroethylsulfamoylamino)cyclobutan-1-ol
CID 114809878
trans-(1S,3S)-2,2-dimethyl-3-(propan-2-ylamino)cyclobutan-1-ol
CID 146535076
cis-(1R,3S)-2,2-dimethyl-3-(propan-2-ylamino)cyclobutan-1-ol
CID 169587975
1-[[Butyl(methyl)sulfamoyl]amino]-3-hydroxycyclobutane
CID 65970472
N-(3-hydroxycyclobutyl)-3,5-dimethylpiperidine-1-sulfonamide
CID 65973161
N-(3-hydroxycyclobutyl)-3-methylpiperidine-1-sulfonamide
CID 65973618
1-Hydroxy-3-[[[methyl(propan-2-yl)sulfamoyl]amino]methyl]cyclobutane
CID 66005456
5-Hydroxy-2,2-dimethyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]pentane
CID 75399335
(2S,4S)-2-(dimethylsulfamoylamino)-1,4-dihydroxy-5,5-dimethylhexane
CID 100638573
(2R,4S)-2-(dimethylsulfamoylamino)-1,4-dihydroxy-5,5-dimethylhexane
CID 100638588
(2S,4R)-2-(dimethylsulfamoylamino)-1,4-dihydroxy-5,5-dimethylhexane
CID 100638604

Frequently Asked Questions

What is the IUPAC name of 2-[[butyl(methyl)sulfamoyl]amino]-4-hydroxy-1,1-dimethylcyclobutane?
The IUPAC name of 2-[[butyl(methyl)sulfamoyl]amino]-4-hydroxy-1,1-dimethylcyclobutane (CID 114631521) is 2-[[butyl(methyl)sulfamoyl]amino]-4-hydroxy-1,1-dimethylcyclobutane.
What is the SMILES notation for 2-[[butyl(methyl)sulfamoyl]amino]-4-hydroxy-1,1-dimethylcyclobutane?
The canonical SMILES for 2-[[butyl(methyl)sulfamoyl]amino]-4-hydroxy-1,1-dimethylcyclobutane is CCCCN(C)S(=O)(=O)NC1CC(O)C1(C)C.
What is the InChIKey of 2-[[butyl(methyl)sulfamoyl]amino]-4-hydroxy-1,1-dimethylcyclobutane?
The InChIKey is LQNXDNAUAOVHEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3S/c1-5-6-7-13(4)17(15,16)12-9-8-10(14)11(9,2)3/h9-10,12,14H,5-8H2,1-4H3.
What are the key properties of 2-[[butyl(methyl)sulfamoyl]amino]-4-hydroxy-1,1-dimethylcyclobutane?
2-[[butyl(methyl)sulfamoyl]amino]-4-hydroxy-1,1-dimethylcyclobutane has a molecular weight of 264.39 g/mol, XLogP of 0.71, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[butyl(methyl)sulfamoyl]amino]-4-hydroxy-1,1-dimethylcyclobutane is sourced from PubChem (CID 114631521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).