methane;propane-1-sulfonamide

C11H41NO2S — CID 159650684

IUPACmethane;propane-1-sulfonamide
SMILESC.C.C.C.C.C.C.C.CCCS(N)(=O)=O
InChIInChI=1S/C3H9NO2S.8CH4/c1-2-3-7(4,5)6;;;;;;;;/h2-3H2,1H3,(H2,4,5,6);8*1H4
InChIKeyMRNKDEUAQLWKMI-UHFFFAOYSA-N
MW251.52 g/mol
LogP4.77
Rot. Bonds2

About methane;propane-1-sulfonamide

methane;propane-1-sulfonamide (PubChem CID 159650684) has the molecular formula C11H41NO2S and a molecular weight of 251.52 g/mol. Its IUPAC name is methane;propane-1-sulfonamide.

Molecular Properties

Compound Namemethane;propane-1-sulfonamide
PubChem CID159650684
Molecular FormulaC11H41NO2S
Molecular Weight251.52 g/mol
Exact Mass251.29
IUPAC Namemethane;propane-1-sulfonamide
SMILESC.C.C.C.C.C.C.C.CCCS(N)(=O)=O
InChIInChI=1S/C3H9NO2S.8CH4/c1-2-3-7(4,5)6;;;;;;;;/h2-3H2,1H3,(H2,4,5,6);8*1H4
InChIKeyMRNKDEUAQLWKMI-UHFFFAOYSA-N
XLogP4.77
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.52
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

CID 160808484
CID 160808484
butane-1-sulfonamide;dihydrochloride
CID 140980497
CID 175918224
CID 175918224
N-(2-sulfamoylethyl)propane-1-sulfonamide
CID 61131733
pentacosane-1-sulfonamide
CID 149252389
1-propylsulfonylpropane
CID 11709
propane-1,3-disulfonamide
CID 22153832
1-[1,2,2-tris(propylsulfonyl)ethenylsulfonyl]propane
CID 3457689
butane-1-sulfonamide;trifluoromethanesulfonamide
CID 87836175
3,3-diethylpentane-1-sulfonamide
CID 154281864
2-(pentylamino)ethanesulfonamide
CID 43551719
hydrazine;propane-1-sulfonic acid
CID 159325511

Frequently Asked Questions

What is the IUPAC name of methane;propane-1-sulfonamide?
The IUPAC name of methane;propane-1-sulfonamide (CID 159650684) is methane;propane-1-sulfonamide.
What is the SMILES notation for methane;propane-1-sulfonamide?
The canonical SMILES for methane;propane-1-sulfonamide is C.C.C.C.C.C.C.C.CCCS(N)(=O)=O.
What is the InChIKey of methane;propane-1-sulfonamide?
The InChIKey is MRNKDEUAQLWKMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9NO2S.8CH4/c1-2-3-7(4,5)6;;;;;;;;/h2-3H2,1H3,(H2,4,5,6);8*1H4.
What are the key properties of methane;propane-1-sulfonamide?
methane;propane-1-sulfonamide has a molecular weight of 251.52 g/mol, XLogP of 4.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methane;propane-1-sulfonamide is sourced from PubChem (CID 159650684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).