6-amino-4-ethyl-N-[2-(2-hydroxyethoxy)ethyl]-N-methylhexanamide

C13H28N2O3 — CID 114243064

IUPAC6-amino-4-ethyl-N-[2-(2-hydroxyethoxy)ethyl]-N-methylhexanamide
SMILESCCC(CCN)CCC(=O)N(C)CCOCCO
InChIInChI=1S/C13H28N2O3/c1-3-12(6-7-14)4-5-13(17)15(2)8-10-18-11-9-16/h12,16H,3-11,14H2,1-2H3
InChIKeyIEDKOORJSNFOMG-UHFFFAOYSA-N
MW260.38 g/mol
LogP0.61
Rot. Bonds11

About 6-amino-4-ethyl-N-[2-(2-hydroxyethoxy)ethyl]-N-methylhexanamide

6-amino-4-ethyl-N-[2-(2-hydroxyethoxy)ethyl]-N-methylhexanamide (PubChem CID 114243064) has the molecular formula C13H28N2O3 and a molecular weight of 260.38 g/mol. Its IUPAC name is 6-amino-4-ethyl-N-[2-(2-hydroxyethoxy)ethyl]-N-methylhexanamide.

Molecular Properties

Compound Name6-amino-4-ethyl-N-[2-(2-hydroxyethoxy)ethyl]-N-methylhexanamide
PubChem CID114243064
Molecular FormulaC13H28N2O3
Molecular Weight260.38 g/mol
Exact Mass260.21
IUPAC Name6-amino-4-ethyl-N-[2-(2-hydroxyethoxy)ethyl]-N-methylhexanamide
SMILESCCC(CCN)CCC(=O)N(C)CCOCCO
InChIInChI=1S/C13H28N2O3/c1-3-12(6-7-14)4-5-13(17)15(2)8-10-18-11-9-16/h12,16H,3-11,14H2,1-2H3
InChIKeyIEDKOORJSNFOMG-UHFFFAOYSA-N
XLogP0.61
TPSA75.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-amino-N-(2-ethoxyethyl)-4-ethyl-N-methylhexanamide
CID 81059329
6-amino-4-ethyl-N-methyl-N-(2-methylsulfanylethyl)hexanamide
CID 112658971
6-amino-4-ethyl-N-(2-hydroxy-2-methylpropyl)-N-methylhexanamide
CID 79379037
3-amino-N-(2-ethoxyethyl)-N-methylpropanamide
CID 81058300
4-amino-N-(2-ethoxyethyl)-N-methylbutanamide
CID 81058942
methyl (2S)-2-amino-5-[2-(2-ethoxyethoxy)ethyl-methylamino]-5-oxopentanoate
CID 156858129
N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-N-methylpropanamide
CID 168897621
6-amino-N-(2-ethoxyethyl)-N-methylhexanamide
CID 81059139
6-amino-N-ethoxy-4-ethylhexanamide
CID 64974724
N-[2-(2-aminoethoxy)ethyl]-N-methyl-3-(2,2,2-trifluoroethoxy)propanamide
CID 114243684
8-amino-6-ethyloctan-3-one
CID 116578085
N,N'-bis[2-(2-hydroxyethoxy)ethyl]-N'-methylicosanediamide
CID 89140505

Frequently Asked Questions

What is the IUPAC name of 6-amino-4-ethyl-N-[2-(2-hydroxyethoxy)ethyl]-N-methylhexanamide?
The IUPAC name of 6-amino-4-ethyl-N-[2-(2-hydroxyethoxy)ethyl]-N-methylhexanamide (CID 114243064) is 6-amino-4-ethyl-N-[2-(2-hydroxyethoxy)ethyl]-N-methylhexanamide.
What is the SMILES notation for 6-amino-4-ethyl-N-[2-(2-hydroxyethoxy)ethyl]-N-methylhexanamide?
The canonical SMILES for 6-amino-4-ethyl-N-[2-(2-hydroxyethoxy)ethyl]-N-methylhexanamide is CCC(CCN)CCC(=O)N(C)CCOCCO.
What is the InChIKey of 6-amino-4-ethyl-N-[2-(2-hydroxyethoxy)ethyl]-N-methylhexanamide?
The InChIKey is IEDKOORJSNFOMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O3/c1-3-12(6-7-14)4-5-13(17)15(2)8-10-18-11-9-16/h12,16H,3-11,14H2,1-2H3.
What are the key properties of 6-amino-4-ethyl-N-[2-(2-hydroxyethoxy)ethyl]-N-methylhexanamide?
6-amino-4-ethyl-N-[2-(2-hydroxyethoxy)ethyl]-N-methylhexanamide has a molecular weight of 260.38 g/mol, XLogP of 0.61, 11 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-4-ethyl-N-[2-(2-hydroxyethoxy)ethyl]-N-methylhexanamide is sourced from PubChem (CID 114243064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).