N,N-di(propan-2-yl)ethanesulfonamide

C8H19NO2S — CID 3289511

IUPACN,N-di(propan-2-yl)ethanesulfonamide
SMILESCCS(=O)(=O)N(C(C)C)C(C)C
InChIInChI=1S/C8H19NO2S/c1-6-12(10,11)9(7(2)3)8(4)5/h7-8H,6H2,1-5H3
InChIKeyVYFPUZDJZFGPQY-UHFFFAOYSA-N
MW193.31 g/mol
LogP1.45
Rot. Bonds4

About N,N-di(propan-2-yl)ethanesulfonamide

N,N-di(propan-2-yl)ethanesulfonamide (PubChem CID 3289511) has the molecular formula C8H19NO2S and a molecular weight of 193.31 g/mol. Its IUPAC name is N,N-di(propan-2-yl)ethanesulfonamide.

Molecular Properties

Compound NameN,N-di(propan-2-yl)ethanesulfonamide
PubChem CID3289511
Molecular FormulaC8H19NO2S
Molecular Weight193.31 g/mol
Exact Mass193.11
IUPAC NameN,N-di(propan-2-yl)ethanesulfonamide
SMILESCCS(=O)(=O)N(C(C)C)C(C)C
InChIInChI=1S/C8H19NO2S/c1-6-12(10,11)9(7(2)3)8(4)5/h7-8H,6H2,1-5H3
InChIKeyVYFPUZDJZFGPQY-UHFFFAOYSA-N
XLogP1.45
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.31
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

pentan-3-yl(propan-2-yl)sulfamic acid
CID 156663474
methyl 2-[di(propan-2-yl)sulfamoyl]ethanedithioate
CID 117059204
2-[ethylsulfamoylsulfonyl(propan-2-yl)amino]propane
CID 173311356
N-(2-bromopropyl)-N-methylethanesulfonamide
CID 80671739
di(butan-2-yl)sulfamic acid
CID 156663387
N-chloro-N-methylethanesulfonamide
CID 174844649
N-(cyclopropylmethyl)-N-propan-2-ylethanesulfonamide
CID 63738150
N-butyl-2-methyl-N-propan-2-ylpropane-1-sulfonamide
CID 89281493
2-[[2-[ethylsulfonyl(methyl)amino]acetyl]amino]propanoic acid
CID 119348539
2-[ethylsulfonyl(methyl)amino]-N-hydroxypropanamide
CID 59950844
N,N-dipentylethanesulfonamide
CID 3453334
(2R)-N-ethyl-N,2-dimethylbutane-1-sulfonamide
CID 97095663

Frequently Asked Questions

What is the IUPAC name of N,N-di(propan-2-yl)ethanesulfonamide?
The IUPAC name of N,N-di(propan-2-yl)ethanesulfonamide (CID 3289511) is N,N-di(propan-2-yl)ethanesulfonamide.
What is the SMILES notation for N,N-di(propan-2-yl)ethanesulfonamide?
The canonical SMILES for N,N-di(propan-2-yl)ethanesulfonamide is CCS(=O)(=O)N(C(C)C)C(C)C.
What is the InChIKey of N,N-di(propan-2-yl)ethanesulfonamide?
The InChIKey is VYFPUZDJZFGPQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO2S/c1-6-12(10,11)9(7(2)3)8(4)5/h7-8H,6H2,1-5H3.
What are the key properties of N,N-di(propan-2-yl)ethanesulfonamide?
N,N-di(propan-2-yl)ethanesulfonamide has a molecular weight of 193.31 g/mol, XLogP of 1.45, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-di(propan-2-yl)ethanesulfonamide is sourced from PubChem (CID 3289511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).