3-[2-[ethoxy(dimethyl)silyl]ethyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine

C25H57N3OSi — CID 142718241

IUPAC3-[2-[ethoxy(dimethyl)silyl]ethyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine
SMILESCCCN(C)CCC(CCN(C)CCC)(CCN(C)CCC)CC[Si](C)(C)OCC
InChIInChI=1S/C25H57N3OSi/c1-10-18-26(5)21-14-25(15-22-27(6)19-11-2,16-23-28(7)20-12-3)17-24-30(8,9)29-13-4/h10-24H2,1-9H3
InChIKeyBEHHQKYIJJOJJR-UHFFFAOYSA-N
MW443.84 g/mol
LogP5.80
Rot. Bonds20

About 3-[2-[ethoxy(dimethyl)silyl]ethyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine

3-[2-[ethoxy(dimethyl)silyl]ethyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine (PubChem CID 142718241) has the molecular formula C25H57N3OSi and a molecular weight of 443.84 g/mol. Its IUPAC name is 3-[2-[ethoxy(dimethyl)silyl]ethyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine.

Molecular Properties

Compound Name3-[2-[ethoxy(dimethyl)silyl]ethyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine
PubChem CID142718241
Molecular FormulaC25H57N3OSi
Molecular Weight443.84 g/mol
Exact Mass443.43
IUPAC Name3-[2-[ethoxy(dimethyl)silyl]ethyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine
SMILESCCCN(C)CCC(CCN(C)CCC)(CCN(C)CCC)CC[Si](C)(C)OCC
InChIInChI=1S/C25H57N3OSi/c1-10-18-26(5)21-14-25(15-22-27(6)19-11-2,16-23-28(7)20-12-3)17-24-30(8,9)29-13-4/h10-24H2,1-9H3
InChIKeyBEHHQKYIJJOJJR-UHFFFAOYSA-N
XLogP5.80
TPSA18.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds20
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500443.84
LogP ≤ 55.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[2-(dipropylamino)ethyl]-N,N,N',N'-tetrapropyl-3-(2-triethoxysilylethyl)pentane-1,5-diamine
CID 142718234
3-[2-(dipropylamino)ethyl]-3-[2-[methoxy(dimethyl)silyl]ethyl]-N,N,N',N'-tetrapropylpentane-1,5-diamine
CID 142718275
N,N'-diethyl-3-[2-[ethyl(propyl)amino]ethyl]-N,N'-dipropyl-3-(2-triethoxysilylethyl)pentane-1,5-diamine
CID 142718377
4-[3-(dipropylamino)propyl]-4-[2-(ethoxy-ethyl-methylsilyl)ethyl]-N,N,N',N'-tetrapropylheptane-1,7-diamine
CID 140647594
3-[ethoxy(dimethyl)silyl]-N,N-dipropylpropan-1-amine
CID 87204397
3-[2-(diethylamino)ethyl]-3-[[ethoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetraethylpentane-1,5-diamine
CID 142718358
3-[[diethyl(methoxy)silyl]methyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine
CID 142718361
N'-[2-(ethoxy-ethyl-methylsilyl)ethyl]-N-methyl-N'-[3-[methyl(propyl)amino]propyl]-N-propylpropane-1,3-diamine
CID 140647243
3-[[ethyl(dimethoxy)silyl]methyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine
CID 142718348
3-[2-[diethoxy(ethyl)silyl]ethyl]-3-[2-(diethylamino)ethyl]-N,N,N',N'-tetraethylpentane-1,5-diamine
CID 142718312
2-[[ethoxy(dimethyl)silyl]methyl]-N,N'-diethyl-2-[[ethyl(propyl)amino]methyl]-N,N'-dipropylpropane-1,3-diamine
CID 140647426
[tert-butyl(dimethyl)silyl] 3-[3-[ethoxy(dimethyl)silyl]propyl-methylamino]propanoate
CID 88852155

Frequently Asked Questions

What is the IUPAC name of 3-[2-[ethoxy(dimethyl)silyl]ethyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine?
The IUPAC name of 3-[2-[ethoxy(dimethyl)silyl]ethyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine (CID 142718241) is 3-[2-[ethoxy(dimethyl)silyl]ethyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine.
What is the SMILES notation for 3-[2-[ethoxy(dimethyl)silyl]ethyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine?
The canonical SMILES for 3-[2-[ethoxy(dimethyl)silyl]ethyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine is CCCN(C)CCC(CCN(C)CCC)(CCN(C)CCC)CC[Si](C)(C)OCC.
What is the InChIKey of 3-[2-[ethoxy(dimethyl)silyl]ethyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine?
The InChIKey is BEHHQKYIJJOJJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H57N3OSi/c1-10-18-26(5)21-14-25(15-22-27(6)19-11-2,16-23-28(7)20-12-3)17-24-30(8,9)29-13-4/h10-24H2,1-9H3.
What are the key properties of 3-[2-[ethoxy(dimethyl)silyl]ethyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine?
3-[2-[ethoxy(dimethyl)silyl]ethyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine has a molecular weight of 443.84 g/mol, XLogP of 5.80, 20 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[ethoxy(dimethyl)silyl]ethyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine is sourced from PubChem (CID 142718241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).