2-[2-[2-[2,2-bis(dimethylamino)ethoxy]ethoxy]ethoxy]-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine

C16H38N4O3 — CID 141061045

IUPAC2-[2-[2-[2,2-bis(dimethylamino)ethoxy]ethoxy]ethoxy]-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine
SMILESCN(C)C(COCCOCCOCC(N(C)C)N(C)C)N(C)C
InChIInChI=1S/C16H38N4O3/c1-17(2)15(18(3)4)13-22-11-9-21-10-12-23-14-16(19(5)6)20(7)8/h15-16H,9-14H2,1-8H3
InChIKeyRGXPNFCTRRCDQN-UHFFFAOYSA-N
MW334.51 g/mol
LogP-0.07
Rot. Bonds14

About 2-[2-[2-[2,2-bis(dimethylamino)ethoxy]ethoxy]ethoxy]-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine

2-[2-[2-[2,2-bis(dimethylamino)ethoxy]ethoxy]ethoxy]-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine (PubChem CID 141061045) has the molecular formula C16H38N4O3 and a molecular weight of 334.51 g/mol. Its IUPAC name is 2-[2-[2-[2,2-bis(dimethylamino)ethoxy]ethoxy]ethoxy]-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine.

Molecular Properties

Compound Name2-[2-[2-[2,2-bis(dimethylamino)ethoxy]ethoxy]ethoxy]-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine
PubChem CID141061045
Molecular FormulaC16H38N4O3
Molecular Weight334.51 g/mol
Exact Mass334.29
IUPAC Name2-[2-[2-[2,2-bis(dimethylamino)ethoxy]ethoxy]ethoxy]-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine
SMILESCN(C)C(COCCOCCOCC(N(C)C)N(C)C)N(C)C
InChIInChI=1S/C16H38N4O3/c1-17(2)15(18(3)4)13-22-11-9-21-10-12-23-14-16(19(5)6)20(7)8/h15-16H,9-14H2,1-8H3
InChIKeyRGXPNFCTRRCDQN-UHFFFAOYSA-N
XLogP-0.07
TPSA40.65 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds14
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.51
LogP ≤ 5-0.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-[2-(dimethylamino)ethoxy]-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine
CID 154420460
1-(dimethylamino)-2-[2-[2-(dimethylamino)-2-hydroxyethoxy]ethoxy]ethanol
CID 170282513
2-(1-amino-2-methylpropoxy)-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine
CID 57098309
2-[2-[2-[2-[2-(2,2-difluoroethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1,1-difluoroethane
CID 170162541
1-(dimethylamino)-3-[2-[2-(dimethylamino)-2-hydroxyethoxy]ethoxy]propan-2-ol
CID 58067985
2-methyl-1-[1-[2-[2-(2-methylpropoxy)propoxy]ethoxy]propan-2-yloxy]propane
CID 58121620
1-[2-[2-[2-(2-hydroxybutoxy)ethoxy]ethoxy]ethoxy]butan-2-ol
CID 12645981
3-methyl-1-[2-(2-methylpropoxy)ethoxy]butane
CID 90326526
(2R)-1-[2-[2-[(2R)-2-amino-3-methylbutoxy]ethoxy]ethoxy]-3-methylbutan-2-amine
CID 101253534
2-[2-[2-(dimethylamino)ethoxy]ethoxy]-N,N-dimethylethanamine;ethane
CID 168987783
2-[2-[2-[2-(difluoroamino)-1,1,2-trifluoroethoxy]ethoxy]ethoxy]-1,2,2-trifluoro-N,N-dimethylethanamine
CID 131974281
2-[2-[2-[2-[2-[2-(2-methylpropoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 6428225

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2,2-bis(dimethylamino)ethoxy]ethoxy]ethoxy]-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine?
The IUPAC name of 2-[2-[2-[2,2-bis(dimethylamino)ethoxy]ethoxy]ethoxy]-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine (CID 141061045) is 2-[2-[2-[2,2-bis(dimethylamino)ethoxy]ethoxy]ethoxy]-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine.
What is the SMILES notation for 2-[2-[2-[2,2-bis(dimethylamino)ethoxy]ethoxy]ethoxy]-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine?
The canonical SMILES for 2-[2-[2-[2,2-bis(dimethylamino)ethoxy]ethoxy]ethoxy]-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine is CN(C)C(COCCOCCOCC(N(C)C)N(C)C)N(C)C.
What is the InChIKey of 2-[2-[2-[2,2-bis(dimethylamino)ethoxy]ethoxy]ethoxy]-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine?
The InChIKey is RGXPNFCTRRCDQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H38N4O3/c1-17(2)15(18(3)4)13-22-11-9-21-10-12-23-14-16(19(5)6)20(7)8/h15-16H,9-14H2,1-8H3.
What are the key properties of 2-[2-[2-[2,2-bis(dimethylamino)ethoxy]ethoxy]ethoxy]-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine?
2-[2-[2-[2,2-bis(dimethylamino)ethoxy]ethoxy]ethoxy]-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine has a molecular weight of 334.51 g/mol, XLogP of -0.07, 14 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2,2-bis(dimethylamino)ethoxy]ethoxy]ethoxy]-1-N,1-N,1-N',1-N'-tetramethylethane-1,1-diamine is sourced from PubChem (CID 141061045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).