N-ethyl-N-tetradecylmethanesulfonamide

C17H37NO2S — CID 91715481

IUPACN-ethyl-N-tetradecylmethanesulfonamide
SMILESCCCCCCCCCCCCCCN(CC)S(C)(=O)=O
InChIInChI=1S/C17H37NO2S/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18(5-2)21(3,19)20/h4-17H2,1-3H3
InChIKeyALAQPBDIAIWIQW-UHFFFAOYSA-N
MW319.56 g/mol
LogP4.97
Rot. Bonds15

About N-ethyl-N-tetradecylmethanesulfonamide

N-ethyl-N-tetradecylmethanesulfonamide (PubChem CID 91715481) has the molecular formula C17H37NO2S and a molecular weight of 319.56 g/mol. Its IUPAC name is N-ethyl-N-tetradecylmethanesulfonamide.

Molecular Properties

Compound NameN-ethyl-N-tetradecylmethanesulfonamide
PubChem CID91715481
Molecular FormulaC17H37NO2S
Molecular Weight319.56 g/mol
Exact Mass319.25
IUPAC NameN-ethyl-N-tetradecylmethanesulfonamide
SMILESCCCCCCCCCCCCCCN(CC)S(C)(=O)=O
InChIInChI=1S/C17H37NO2S/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18(5-2)21(3,19)20/h4-17H2,1-3H3
InChIKeyALAQPBDIAIWIQW-UHFFFAOYSA-N
XLogP4.97
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds15
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.56
LogP ≤ 54.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-N-(4-iodobutyl)methanesulfonamide
CID 89182748
N-ethyl-N-octyloctane-1-sulfonamide
CID 176689597
N,N-dipentylethanesulfonamide
CID 3453334
N,N,N',N'-tetrahexylmethanedisulfonamide
CID 140586824
3-[hexyl(methylsulfonyl)amino]-2-methylpropanoic acid
CID 82326382
N,N-dioctyldodecane-1-sulfonamide
CID 15510197
bis(N,N-dihexylhexan-1-amine);sulfuric acid
CID 71357248
N,N-dihexylhexan-1-amine;sulfuric acid
CID 172853690
N-(2-chloroethyl)-N-ethylmethanesulfonamide
CID 63397656
N-(3-bromopropyl)-N-butylmethanesulfonamide
CID 138921783
3-[ethyl(methylsulfonyl)amino]propanoic acid
CID 39239435
heptane;methylsulfonylmethane
CID 176706405

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-tetradecylmethanesulfonamide?
The IUPAC name of N-ethyl-N-tetradecylmethanesulfonamide (CID 91715481) is N-ethyl-N-tetradecylmethanesulfonamide.
What is the SMILES notation for N-ethyl-N-tetradecylmethanesulfonamide?
The canonical SMILES for N-ethyl-N-tetradecylmethanesulfonamide is CCCCCCCCCCCCCCN(CC)S(C)(=O)=O.
What is the InChIKey of N-ethyl-N-tetradecylmethanesulfonamide?
The InChIKey is ALAQPBDIAIWIQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H37NO2S/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18(5-2)21(3,19)20/h4-17H2,1-3H3.
What are the key properties of N-ethyl-N-tetradecylmethanesulfonamide?
N-ethyl-N-tetradecylmethanesulfonamide has a molecular weight of 319.56 g/mol, XLogP of 4.97, 15 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-tetradecylmethanesulfonamide is sourced from PubChem (CID 91715481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).