N-ethyl-2-(2-ethylsulfanylethylamino)-N-methylpropanamide

C10H22N2OS — CID 103108877

IUPACN-ethyl-2-(2-ethylsulfanylethylamino)-N-methylpropanamide
SMILESCCSCCNC(C)C(=O)N(C)CC
InChIInChI=1S/C10H22N2OS/c1-5-12(4)10(13)9(3)11-7-8-14-6-2/h9,11H,5-8H2,1-4H3
InChIKeyXCMXBJZGYCPADW-UHFFFAOYSA-N
MW218.37 g/mol
LogP1.20
Rot. Bonds7

About N-ethyl-2-(2-ethylsulfanylethylamino)-N-methylpropanamide

N-ethyl-2-(2-ethylsulfanylethylamino)-N-methylpropanamide (PubChem CID 103108877) has the molecular formula C10H22N2OS and a molecular weight of 218.37 g/mol. Its IUPAC name is N-ethyl-2-(2-ethylsulfanylethylamino)-N-methylpropanamide.

Molecular Properties

Compound NameN-ethyl-2-(2-ethylsulfanylethylamino)-N-methylpropanamide
PubChem CID103108877
Molecular FormulaC10H22N2OS
Molecular Weight218.37 g/mol
Exact Mass218.15
IUPAC NameN-ethyl-2-(2-ethylsulfanylethylamino)-N-methylpropanamide
SMILESCCSCCNC(C)C(=O)N(C)CC
InChIInChI=1S/C10H22N2OS/c1-5-12(4)10(13)9(3)11-7-8-14-6-2/h9,11H,5-8H2,1-4H3
InChIKeyXCMXBJZGYCPADW-UHFFFAOYSA-N
XLogP1.20
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.37
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-ethyl-2-(2-ethylsulfanylethylamino)-N-methylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(butylamino)-N-ethyl-N-methylpropanamide
CID 103107906
N-ethyl-2-(hexylamino)-N-methylpropanamide
CID 103107347
N-ethyl-2-[(3-hydroxy-3-methylbutyl)amino]-N-methylpropanamide
CID 103108355
2-(cyanomethylamino)-N-ethyl-N-methylpropanamide
CID 103108493
methyl 4-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]amino]butanoate
CID 103108728
2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-ethyl-N-methylpropanamide
CID 103108801
tert-butyl 3-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]amino]propanoate
CID 103268735
N-ethyl-N-methyl-2-(propan-2-ylamino)propanamide
CID 103107904
2-(cyclopropylmethylamino)-N-ethyl-N-methylpropanamide
CID 103106979
N-ethyl-N-methyl-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]propanamide
CID 103108695
2-(1,1-difluoropropan-2-ylamino)-N-ethyl-N-methylpropanamide
CID 103107862
(2R)-2-(3-ethylsulfanylpropylamino)propanoic acid
CID 104863677

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(2-ethylsulfanylethylamino)-N-methylpropanamide?
The IUPAC name of N-ethyl-2-(2-ethylsulfanylethylamino)-N-methylpropanamide (CID 103108877) is N-ethyl-2-(2-ethylsulfanylethylamino)-N-methylpropanamide.
What is the SMILES notation for N-ethyl-2-(2-ethylsulfanylethylamino)-N-methylpropanamide?
The canonical SMILES for N-ethyl-2-(2-ethylsulfanylethylamino)-N-methylpropanamide is CCSCCNC(C)C(=O)N(C)CC.
What is the InChIKey of N-ethyl-2-(2-ethylsulfanylethylamino)-N-methylpropanamide?
The InChIKey is XCMXBJZGYCPADW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2OS/c1-5-12(4)10(13)9(3)11-7-8-14-6-2/h9,11H,5-8H2,1-4H3.
What are the key properties of N-ethyl-2-(2-ethylsulfanylethylamino)-N-methylpropanamide?
N-ethyl-2-(2-ethylsulfanylethylamino)-N-methylpropanamide has a molecular weight of 218.37 g/mol, XLogP of 1.20, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(2-ethylsulfanylethylamino)-N-methylpropanamide is sourced from PubChem (CID 103108877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).