N-[2-[2-[2-(tert-butylamino)ethoxy]ethoxy]ethyl]-N,2-dimethylpropanamide

C15H32N2O3 — CID 176777052

IUPACN-[2-[2-[2-(tert-butylamino)ethoxy]ethoxy]ethyl]-N,2-dimethylpropanamide
SMILESCC(C)C(=O)N(C)CCOCCOCCNC(C)(C)C
InChIInChI=1S/C15H32N2O3/c1-13(2)14(18)17(6)8-10-20-12-11-19-9-7-16-15(3,4)5/h13,16H,7-12H2,1-6H3
InChIKeyWBJPXGWJYTUDER-UHFFFAOYSA-N
MW288.43 g/mol
LogP1.52
Rot. Bonds10

About N-[2-[2-[2-(tert-butylamino)ethoxy]ethoxy]ethyl]-N,2-dimethylpropanamide

N-[2-[2-[2-(tert-butylamino)ethoxy]ethoxy]ethyl]-N,2-dimethylpropanamide (PubChem CID 176777052) has the molecular formula C15H32N2O3 and a molecular weight of 288.43 g/mol. Its IUPAC name is N-[2-[2-[2-(tert-butylamino)ethoxy]ethoxy]ethyl]-N,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[2-[2-[2-(tert-butylamino)ethoxy]ethoxy]ethyl]-N,2-dimethylpropanamide
PubChem CID176777052
Molecular FormulaC15H32N2O3
Molecular Weight288.43 g/mol
Exact Mass288.24
IUPAC NameN-[2-[2-[2-(tert-butylamino)ethoxy]ethoxy]ethyl]-N,2-dimethylpropanamide
SMILESCC(C)C(=O)N(C)CCOCCOCCNC(C)(C)C
InChIInChI=1S/C15H32N2O3/c1-13(2)14(18)17(6)8-10-20-12-11-19-9-7-16-15(3,4)5/h13,16H,7-12H2,1-6H3
InChIKeyWBJPXGWJYTUDER-UHFFFAOYSA-N
XLogP1.52
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.43
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[2-[2-(tert-butylamino)ethoxy]ethoxy]-3-methylbutan-2-one
CID 138460886
N-(2-ethoxyethyl)-N,2-dimethylpropanamide
CID 11423854
N,2-dimethyl-N-(2-pentoxyethyl)propanamide
CID 163400229
1-[2-[2-[2-[2-(tert-butylamino)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-one
CID 166662752
4-[2-[2-[2-[2-(tert-butylamino)ethoxy]ethoxy]ethoxy]ethoxy]butan-2-one
CID 177194352
2-methyl-N-[2-[2-[2-(3-methylbutoxy)ethoxy]ethoxy]ethyl]propan-2-amine
CID 135302587
N-[2-[2-[2-[2-(tert-butylamino)ethoxy]ethoxy]ethoxy]ethyl]-2,2-dimethylpropanamide
CID 156551208
1-[2-[2-[2-(tert-butylamino)ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one
CID 59078266
N-[2-[3-[2-[2-(tert-butylamino)ethoxy]ethoxy]propoxy]ethyl]-2-methylpropan-2-amine
CID 129102277
2-methyl-N-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethyl]propan-2-amine
CID 138466955
1-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(tert-butylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one;1-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4,4-dimethylpentan-3-one
CID 157213065
N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-2-methylpropan-2-amine
CID 58904017

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[2-(tert-butylamino)ethoxy]ethoxy]ethyl]-N,2-dimethylpropanamide?
The IUPAC name of N-[2-[2-[2-(tert-butylamino)ethoxy]ethoxy]ethyl]-N,2-dimethylpropanamide (CID 176777052) is N-[2-[2-[2-(tert-butylamino)ethoxy]ethoxy]ethyl]-N,2-dimethylpropanamide.
What is the SMILES notation for N-[2-[2-[2-(tert-butylamino)ethoxy]ethoxy]ethyl]-N,2-dimethylpropanamide?
The canonical SMILES for N-[2-[2-[2-(tert-butylamino)ethoxy]ethoxy]ethyl]-N,2-dimethylpropanamide is CC(C)C(=O)N(C)CCOCCOCCNC(C)(C)C.
What is the InChIKey of N-[2-[2-[2-(tert-butylamino)ethoxy]ethoxy]ethyl]-N,2-dimethylpropanamide?
The InChIKey is WBJPXGWJYTUDER-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O3/c1-13(2)14(18)17(6)8-10-20-12-11-19-9-7-16-15(3,4)5/h13,16H,7-12H2,1-6H3.
What are the key properties of N-[2-[2-[2-(tert-butylamino)ethoxy]ethoxy]ethyl]-N,2-dimethylpropanamide?
N-[2-[2-[2-(tert-butylamino)ethoxy]ethoxy]ethyl]-N,2-dimethylpropanamide has a molecular weight of 288.43 g/mol, XLogP of 1.52, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[2-(tert-butylamino)ethoxy]ethoxy]ethyl]-N,2-dimethylpropanamide is sourced from PubChem (CID 176777052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).