3-[2-(dipropylamino)ethyl]-3-[2-[methoxy(dimethyl)silyl]ethyl]-N,N,N',N'-tetrapropylpentane-1,5-diamine

C30H67N3OSi — CID 142718275

IUPAC3-[2-(dipropylamino)ethyl]-3-[2-[methoxy(dimethyl)silyl]ethyl]-N,N,N',N'-tetrapropylpentane-1,5-diamine
SMILESCCCN(CCC)CCC(CCN(CCC)CCC)(CCN(CCC)CCC)CC[Si](C)(C)OC
InChIInChI=1S/C30H67N3OSi/c1-10-20-31(21-11-2)26-16-30(19-29-35(8,9)34-7,17-27-32(22-12-3)23-13-4)18-28-33(24-14-5)25-15-6/h10-29H2,1-9H3
InChIKeyCWQLOWXTRFRNAB-UHFFFAOYSA-N
MW513.97 g/mol
LogP7.75
Rot. Bonds25

About 3-[2-(dipropylamino)ethyl]-3-[2-[methoxy(dimethyl)silyl]ethyl]-N,N,N',N'-tetrapropylpentane-1,5-diamine

3-[2-(dipropylamino)ethyl]-3-[2-[methoxy(dimethyl)silyl]ethyl]-N,N,N',N'-tetrapropylpentane-1,5-diamine (PubChem CID 142718275) has the molecular formula C30H67N3OSi and a molecular weight of 513.97 g/mol. Its IUPAC name is 3-[2-(dipropylamino)ethyl]-3-[2-[methoxy(dimethyl)silyl]ethyl]-N,N,N',N'-tetrapropylpentane-1,5-diamine.

Molecular Properties

Compound Name3-[2-(dipropylamino)ethyl]-3-[2-[methoxy(dimethyl)silyl]ethyl]-N,N,N',N'-tetrapropylpentane-1,5-diamine
PubChem CID142718275
Molecular FormulaC30H67N3OSi
Molecular Weight513.97 g/mol
Exact Mass513.51
IUPAC Name3-[2-(dipropylamino)ethyl]-3-[2-[methoxy(dimethyl)silyl]ethyl]-N,N,N',N'-tetrapropylpentane-1,5-diamine
SMILESCCCN(CCC)CCC(CCN(CCC)CCC)(CCN(CCC)CCC)CC[Si](C)(C)OC
InChIInChI=1S/C30H67N3OSi/c1-10-20-31(21-11-2)26-16-30(19-29-35(8,9)34-7,17-27-32(22-12-3)23-13-4)18-28-33(24-14-5)25-15-6/h10-29H2,1-9H3
InChIKeyCWQLOWXTRFRNAB-UHFFFAOYSA-N
XLogP7.75
TPSA18.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds25
Heavy Atoms35
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500513.97
LogP ≤ 57.75
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

N,N'-diethyl-3-[2-[ethyl(propyl)amino]ethyl]-N,N'-dipropyl-3-(2-trimethoxysilylethyl)pentane-1,5-diamine
CID 142718319
4-[3-(diethylamino)propyl]-N,N,N',N'-tetraethyl-4-[2-[methoxy(dimethyl)silyl]ethyl]heptane-1,7-diamine
CID 140647664
3-[2-(dipropylamino)ethyl]-N,N,N',N'-tetrapropyl-3-(2-triethoxysilylethyl)pentane-1,5-diamine
CID 142718234
2-(diethylaminomethyl)-N,N,N',N'-tetraethyl-2-[2-[methoxy(dimethyl)silyl]ethyl]propane-1,3-diamine
CID 140647508
4-[3-(dipropylamino)propyl]-4-[[methoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetrapropylheptane-1,7-diamine
CID 140647719
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-[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
N-[2-[4-[3-[methoxy(dimethyl)silyl]propyl]piperazin-1-yl]ethyl]-N-propylpropan-1-amine
CID 178023180
N,N'-diethyl-3-[[ethyl(dimethoxy)silyl]methyl]-3-[2-[ethyl(propyl)amino]ethyl]-N,N'-dipropylpentane-1,5-diamine
CID 142718352
4-[3-(diethylamino)propyl]-N,N,N',N'-tetraethyl-4-(2-trimethoxysilylethyl)heptane-1,7-diamine
CID 140647245
3-[ethoxy(dimethyl)silyl]-N,N-dipropylpropan-1-amine
CID 87204397

Frequently Asked Questions

What is the IUPAC name of 3-[2-(dipropylamino)ethyl]-3-[2-[methoxy(dimethyl)silyl]ethyl]-N,N,N',N'-tetrapropylpentane-1,5-diamine?
The IUPAC name of 3-[2-(dipropylamino)ethyl]-3-[2-[methoxy(dimethyl)silyl]ethyl]-N,N,N',N'-tetrapropylpentane-1,5-diamine (CID 142718275) is 3-[2-(dipropylamino)ethyl]-3-[2-[methoxy(dimethyl)silyl]ethyl]-N,N,N',N'-tetrapropylpentane-1,5-diamine.
What is the SMILES notation for 3-[2-(dipropylamino)ethyl]-3-[2-[methoxy(dimethyl)silyl]ethyl]-N,N,N',N'-tetrapropylpentane-1,5-diamine?
The canonical SMILES for 3-[2-(dipropylamino)ethyl]-3-[2-[methoxy(dimethyl)silyl]ethyl]-N,N,N',N'-tetrapropylpentane-1,5-diamine is CCCN(CCC)CCC(CCN(CCC)CCC)(CCN(CCC)CCC)CC[Si](C)(C)OC.
What is the InChIKey of 3-[2-(dipropylamino)ethyl]-3-[2-[methoxy(dimethyl)silyl]ethyl]-N,N,N',N'-tetrapropylpentane-1,5-diamine?
The InChIKey is CWQLOWXTRFRNAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H67N3OSi/c1-10-20-31(21-11-2)26-16-30(19-29-35(8,9)34-7,17-27-32(22-12-3)23-13-4)18-28-33(24-14-5)25-15-6/h10-29H2,1-9H3.
What are the key properties of 3-[2-(dipropylamino)ethyl]-3-[2-[methoxy(dimethyl)silyl]ethyl]-N,N,N',N'-tetrapropylpentane-1,5-diamine?
3-[2-(dipropylamino)ethyl]-3-[2-[methoxy(dimethyl)silyl]ethyl]-N,N,N',N'-tetrapropylpentane-1,5-diamine has a molecular weight of 513.97 g/mol, XLogP of 7.75, 25 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(dipropylamino)ethyl]-3-[2-[methoxy(dimethyl)silyl]ethyl]-N,N,N',N'-tetrapropylpentane-1,5-diamine is sourced from PubChem (CID 142718275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).