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

C25H57N3OSi — CID 142718361

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

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

3-[[diethyl(methoxy)silyl]methyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine (PubChem CID 142718361) has the molecular formula C25H57N3OSi and a molecular weight of 443.84 g/mol. Its IUPAC name is 3-[[diethyl(methoxy)silyl]methyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine.

Molecular Properties

Compound Name3-[[diethyl(methoxy)silyl]methyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine
PubChem CID142718361
Molecular FormulaC25H57N3OSi
Molecular Weight443.84 g/mol
Exact Mass443.43
IUPAC Name3-[[diethyl(methoxy)silyl]methyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine
SMILESCCCN(C)CCC(CCN(C)CCC)(CCN(C)CCC)C[Si](CC)(CC)OC
InChIInChI=1S/C25H57N3OSi/c1-10-18-26(6)21-15-25(16-22-27(7)19-11-2,17-23-28(8)20-12-3)24-30(13-4,14-5)29-9/h10-24H2,1-9H3
InChIKeyAURLNPGZBWNROC-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-[[ethyl(dimethoxy)silyl]methyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine
CID 142718348
2-[[diethyl(methoxy)silyl]methyl]-2-[(dimethylamino)methyl]-N,N,N',N'-tetramethylpropane-1,3-diamine
CID 140647573
N,N'-dimethyl-2-[[methyl(propyl)amino]methyl]-N,N'-dipropyl-2-(trimethoxysilylmethyl)propane-1,3-diamine
CID 140647338
3-[2-[ethoxy(dimethyl)silyl]ethyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine
CID 142718241
N,N'-diethyl-3-[[ethyl(dimethoxy)silyl]methyl]-3-[2-[ethyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine
CID 142718352
4-[3-(dimethylamino)propyl]-4-[[ethoxy(diethyl)silyl]methyl]-N,N,N',N'-tetramethylheptane-1,7-diamine
CID 140647576
N,N'-dimethyl-N'-[2-[methyl(propyl)amino]ethyl]-N-propylethane-1,2-diamine
CID 162082787
N-methyl-N-(trimethoxysilylmethyl)propan-1-amine
CID 59845268
4-[3-(dipropylamino)propyl]-4-[[methoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetrapropylheptane-1,7-diamine
CID 140647719
N',2,2-trimethyl-N'-propylbutane-1,4-diamine
CID 65246982
N,N'-diethyl-4-[3-[ethyl(propyl)amino]propyl]-N,N'-dipropyl-4-(trimethoxysilylmethyl)heptane-1,7-diamine
CID 140647551
N'-[2-(ethyl-methoxy-methylsilyl)ethyl]-N-methyl-N'-[3-[methyl(propyl)amino]propyl]-N-propylpropane-1,3-diamine
CID 140647449

Frequently Asked Questions

What is the IUPAC name of 3-[[diethyl(methoxy)silyl]methyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine?
The IUPAC name of 3-[[diethyl(methoxy)silyl]methyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine (CID 142718361) is 3-[[diethyl(methoxy)silyl]methyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine.
What is the SMILES notation for 3-[[diethyl(methoxy)silyl]methyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine?
The canonical SMILES for 3-[[diethyl(methoxy)silyl]methyl]-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)C[Si](CC)(CC)OC.
What is the InChIKey of 3-[[diethyl(methoxy)silyl]methyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine?
The InChIKey is AURLNPGZBWNROC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H57N3OSi/c1-10-18-26(6)21-15-25(16-22-27(7)19-11-2,17-23-28(8)20-12-3)24-30(13-4,14-5)29-9/h10-24H2,1-9H3.
What are the key properties of 3-[[diethyl(methoxy)silyl]methyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine?
3-[[diethyl(methoxy)silyl]methyl]-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-[[diethyl(methoxy)silyl]methyl]-N,N'-dimethyl-3-[2-[methyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine is sourced from PubChem (CID 142718361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).