N-butyl-N-[3-[1-(dibutylamino)propyl-dimethylsilyl]propyl]butan-1-amine

C24H54N2Si — CID 175084814

IUPACN-butyl-N-[3-[1-(dibutylamino)propyl-dimethylsilyl]propyl]butan-1-amine
SMILESCCCCN(CCCC)CCC[Si](C)(C)C(CC)N(CCCC)CCCC
InChIInChI=1S/C24H54N2Si/c1-8-13-18-25(19-14-9-2)20-17-23-27(6,7)24(12-5)26(21-15-10-3)22-16-11-4/h24H,8-23H2,1-7H3
InChIKeyHXNYMJBQOWXFOO-UHFFFAOYSA-N
MW398.80 g/mol
LogP7.21
Rot. Bonds19

About N-butyl-N-[3-[1-(dibutylamino)propyl-dimethylsilyl]propyl]butan-1-amine

N-butyl-N-[3-[1-(dibutylamino)propyl-dimethylsilyl]propyl]butan-1-amine (PubChem CID 175084814) has the molecular formula C24H54N2Si and a molecular weight of 398.80 g/mol. Its IUPAC name is N-butyl-N-[3-[1-(dibutylamino)propyl-dimethylsilyl]propyl]butan-1-amine.

Molecular Properties

Compound NameN-butyl-N-[3-[1-(dibutylamino)propyl-dimethylsilyl]propyl]butan-1-amine
PubChem CID175084814
Molecular FormulaC24H54N2Si
Molecular Weight398.80 g/mol
Exact Mass398.41
IUPAC NameN-butyl-N-[3-[1-(dibutylamino)propyl-dimethylsilyl]propyl]butan-1-amine
SMILESCCCCN(CCCC)CCC[Si](C)(C)C(CC)N(CCCC)CCCC
InChIInChI=1S/C24H54N2Si/c1-8-13-18-25(19-14-9-2)20-17-23-27(6,7)24(12-5)26(21-15-10-3)22-16-11-4/h24H,8-23H2,1-7H3
InChIKeyHXNYMJBQOWXFOO-UHFFFAOYSA-N
XLogP7.21
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds19
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500398.80
LogP ≤ 57.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-butyl-N-[3-[dimethyl(oxido)silyl]propyl]butan-1-amine
CID 102185941
N,N-dibutylbutan-1-amine;tetrahydrate
CID 172865997
N,N-dibutylbutan-1-amine;trihydrate
CID 173345147
N,N,N',N'-tetrabutylethane-1,2-diamine
CID 5224972
N,N-dibutylbutan-1-amine;molecular hydrogen
CID 174513596
N,N-dibutylbutan-1-amine;hydrogen peroxide
CID 87070191
bromomethane;N,N-dibutylbutan-1-amine
CID 87916924
1-[butyl-[3-[dimethoxy(methyl)silyl]propyl]amino]propan-1-ol
CID 174604281
N-butyl-N-propan-2-ylbutan-1-amine;ethane
CID 143004745
N-butyl-N-dodecyldodecan-1-amine;ethane
CID 177188855
N-butyl-N-undecyldodecan-1-amine
CID 168880724
N,N-dipropylbutan-1-amine;hydrofluoride
CID 19783533

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-[3-[1-(dibutylamino)propyl-dimethylsilyl]propyl]butan-1-amine?
The IUPAC name of N-butyl-N-[3-[1-(dibutylamino)propyl-dimethylsilyl]propyl]butan-1-amine (CID 175084814) is N-butyl-N-[3-[1-(dibutylamino)propyl-dimethylsilyl]propyl]butan-1-amine.
What is the SMILES notation for N-butyl-N-[3-[1-(dibutylamino)propyl-dimethylsilyl]propyl]butan-1-amine?
The canonical SMILES for N-butyl-N-[3-[1-(dibutylamino)propyl-dimethylsilyl]propyl]butan-1-amine is CCCCN(CCCC)CCC[Si](C)(C)C(CC)N(CCCC)CCCC.
What is the InChIKey of N-butyl-N-[3-[1-(dibutylamino)propyl-dimethylsilyl]propyl]butan-1-amine?
The InChIKey is HXNYMJBQOWXFOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H54N2Si/c1-8-13-18-25(19-14-9-2)20-17-23-27(6,7)24(12-5)26(21-15-10-3)22-16-11-4/h24H,8-23H2,1-7H3.
What are the key properties of N-butyl-N-[3-[1-(dibutylamino)propyl-dimethylsilyl]propyl]butan-1-amine?
N-butyl-N-[3-[1-(dibutylamino)propyl-dimethylsilyl]propyl]butan-1-amine has a molecular weight of 398.80 g/mol, XLogP of 7.21, 19 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-[3-[1-(dibutylamino)propyl-dimethylsilyl]propyl]butan-1-amine is sourced from PubChem (CID 175084814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).