4-[3-(dipropylamino)propyl]-4-[[methoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetrapropylheptane-1,7-diamine

C32H71N3OSi — CID 140647719

IUPAC4-[3-(dipropylamino)propyl]-4-[[methoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetrapropylheptane-1,7-diamine
SMILESCCCN(CCC)CCCC(CCCN(CCC)CCC)(CCCN(CCC)CCC)C[Si](C)(C)OC
InChIInChI=1S/C32H71N3OSi/c1-10-22-33(23-11-2)28-16-19-32(31-37(8,9)36-7,20-17-29-34(24-12-3)25-13-4)21-18-30-35(26-14-5)27-15-6/h10-31H2,1-9H3
InChIKeyFOJXEKWWGAWPGL-UHFFFAOYSA-N
MW542.03 g/mol
LogP8.53
Rot. Bonds27

About 4-[3-(dipropylamino)propyl]-4-[[methoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetrapropylheptane-1,7-diamine

4-[3-(dipropylamino)propyl]-4-[[methoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetrapropylheptane-1,7-diamine (PubChem CID 140647719) has the molecular formula C32H71N3OSi and a molecular weight of 542.03 g/mol. Its IUPAC name is 4-[3-(dipropylamino)propyl]-4-[[methoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetrapropylheptane-1,7-diamine.

Molecular Properties

Compound Name4-[3-(dipropylamino)propyl]-4-[[methoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetrapropylheptane-1,7-diamine
PubChem CID140647719
Molecular FormulaC32H71N3OSi
Molecular Weight542.03 g/mol
Exact Mass541.54
IUPAC Name4-[3-(dipropylamino)propyl]-4-[[methoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetrapropylheptane-1,7-diamine
SMILESCCCN(CCC)CCCC(CCCN(CCC)CCC)(CCCN(CCC)CCC)C[Si](C)(C)OC
InChIInChI=1S/C32H71N3OSi/c1-10-22-33(23-11-2)28-16-19-32(31-37(8,9)36-7,20-17-29-34(24-12-3)25-13-4)21-18-30-35(26-14-5)27-15-6/h10-31H2,1-9H3
InChIKeyFOJXEKWWGAWPGL-UHFFFAOYSA-N
XLogP8.53
TPSA18.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds27
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500542.03
LogP ≤ 58.53
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-4-[3-[ethyl(propyl)amino]propyl]-N,N'-dipropyl-4-(trimethoxysilylmethyl)heptane-1,7-diamine
CID 140647551
3-[2-(dipropylamino)ethyl]-3-[2-[methoxy(dimethyl)silyl]ethyl]-N,N,N',N'-tetrapropylpentane-1,5-diamine
CID 142718275
4-[3-(diethylamino)propyl]-N,N,N',N'-tetraethyl-4-[2-[methoxy(dimethyl)silyl]ethyl]heptane-1,7-diamine
CID 140647664
4-[3-(dipropylamino)propyl]-4-[2-(ethoxy-ethyl-methylsilyl)ethyl]-N,N,N',N'-tetrapropylheptane-1,7-diamine
CID 140647594
4-[3-(dimethylamino)propyl]-4-[[ethoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetramethylheptane-1,7-diamine
CID 140647381
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
3-[ethoxy(dimethyl)silyl]-N,N-dipropylpropan-1-amine
CID 87204397
4-[3-(diethylamino)propyl]-N,N,N',N'-tetraethyl-4-(2-trimethoxysilylethyl)heptane-1,7-diamine
CID 140647245
2-[[ethoxy(dimethyl)silyl]methyl]-N,N'-diethyl-2-[[ethyl(propyl)amino]methyl]-N,N'-dipropylpropane-1,3-diamine
CID 140647426
4-[3-(diethylamino)propyl]-N,N,N',N'-tetraethyl-4-[2-[ethyl(dimethoxy)silyl]ethyl]heptane-1,7-diamine
CID 140647478
3-[2-(diethylamino)ethyl]-3-[[ethoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetraethylpentane-1,5-diamine
CID 142718358

Frequently Asked Questions

What is the IUPAC name of 4-[3-(dipropylamino)propyl]-4-[[methoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetrapropylheptane-1,7-diamine?
The IUPAC name of 4-[3-(dipropylamino)propyl]-4-[[methoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetrapropylheptane-1,7-diamine (CID 140647719) is 4-[3-(dipropylamino)propyl]-4-[[methoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetrapropylheptane-1,7-diamine.
What is the SMILES notation for 4-[3-(dipropylamino)propyl]-4-[[methoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetrapropylheptane-1,7-diamine?
The canonical SMILES for 4-[3-(dipropylamino)propyl]-4-[[methoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetrapropylheptane-1,7-diamine is CCCN(CCC)CCCC(CCCN(CCC)CCC)(CCCN(CCC)CCC)C[Si](C)(C)OC.
What is the InChIKey of 4-[3-(dipropylamino)propyl]-4-[[methoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetrapropylheptane-1,7-diamine?
The InChIKey is FOJXEKWWGAWPGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H71N3OSi/c1-10-22-33(23-11-2)28-16-19-32(31-37(8,9)36-7,20-17-29-34(24-12-3)25-13-4)21-18-30-35(26-14-5)27-15-6/h10-31H2,1-9H3.
What are the key properties of 4-[3-(dipropylamino)propyl]-4-[[methoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetrapropylheptane-1,7-diamine?
4-[3-(dipropylamino)propyl]-4-[[methoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetrapropylheptane-1,7-diamine has a molecular weight of 542.03 g/mol, XLogP of 8.53, 27 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(dipropylamino)propyl]-4-[[methoxy(dimethyl)silyl]methyl]-N,N,N',N'-tetrapropylheptane-1,7-diamine is sourced from PubChem (CID 140647719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).