N,N'-dibutyl-1-ethenylsilyl-N,N'-dipropylmethanediamine

C17H38N2Si — CID 123785851

IUPACN,N'-dibutyl-1-ethenylsilyl-N,N'-dipropylmethanediamine
SMILESC=C[SiH2]C(N(CCC)CCCC)N(CCC)CCCC
InChIInChI=1S/C17H38N2Si/c1-6-11-15-18(13-8-3)17(20-10-5)19(14-9-4)16-12-7-2/h10,17H,5-9,11-16,20H2,1-4H3
InChIKeyWNNJBGHVLUZKHI-UHFFFAOYSA-N
MW298.59 g/mol
LogP3.61
Rot. Bonds14

About N,N'-dibutyl-1-ethenylsilyl-N,N'-dipropylmethanediamine

N,N'-dibutyl-1-ethenylsilyl-N,N'-dipropylmethanediamine (PubChem CID 123785851) has the molecular formula C17H38N2Si and a molecular weight of 298.59 g/mol. Its IUPAC name is N,N'-dibutyl-1-ethenylsilyl-N,N'-dipropylmethanediamine.

Molecular Properties

Compound NameN,N'-dibutyl-1-ethenylsilyl-N,N'-dipropylmethanediamine
PubChem CID123785851
Molecular FormulaC17H38N2Si
Molecular Weight298.59 g/mol
Exact Mass298.28
IUPAC NameN,N'-dibutyl-1-ethenylsilyl-N,N'-dipropylmethanediamine
SMILESC=C[SiH2]C(N(CCC)CCCC)N(CCC)CCCC
InChIInChI=1S/C17H38N2Si/c1-6-11-15-18(13-8-3)17(20-10-5)19(14-9-4)16-12-7-2/h10,17H,5-9,11-16,20H2,1-4H3
InChIKeyWNNJBGHVLUZKHI-UHFFFAOYSA-N
XLogP3.61
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.59
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-but-1-enylsilyl-N,N,N',N'-tetrapropylmethanediamine
CID 154144939
N-propan-2-yl-N-propylhex-5-en-1-amine
CID 174192838
1-N,1-N'-dibutyl-1-N,1-N'-dipropyl-5-silylpent-4-ene-1,1-diamine
CID 154083964
N'-butan-2-yl-N'-butyl-N-prop-2-enylethane-1,2-diamine
CID 62558135
N-butyl-N-propan-2-ylbutan-1-amine;hydrochloride
CID 173040344
N-butyl-N-propan-2-ylbutan-1-amine;ethane
CID 143004745
1-N,1-N,1-N',1-N'-tetrapropyltridec-2-ene-1,1-diamine
CID 172801320
dipentoxymethyl(ethenyl)silane
CID 123219500
1-N,1-N,1-N',1-N'-tetrabutyl-2-silylprop-2-ene-1,1-diamine
CID 173047733
(2S)-N,N-dibutylhexan-2-amine
CID 124633708
1-N',1-N'-dibutylethane-1,1-diamine
CID 22600656
N,N-dibutylhept-6-en-1-amine
CID 126749828

Frequently Asked Questions

What is the IUPAC name of N,N'-dibutyl-1-ethenylsilyl-N,N'-dipropylmethanediamine?
The IUPAC name of N,N'-dibutyl-1-ethenylsilyl-N,N'-dipropylmethanediamine (CID 123785851) is N,N'-dibutyl-1-ethenylsilyl-N,N'-dipropylmethanediamine.
What is the SMILES notation for N,N'-dibutyl-1-ethenylsilyl-N,N'-dipropylmethanediamine?
The canonical SMILES for N,N'-dibutyl-1-ethenylsilyl-N,N'-dipropylmethanediamine is C=C[SiH2]C(N(CCC)CCCC)N(CCC)CCCC.
What is the InChIKey of N,N'-dibutyl-1-ethenylsilyl-N,N'-dipropylmethanediamine?
The InChIKey is WNNJBGHVLUZKHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H38N2Si/c1-6-11-15-18(13-8-3)17(20-10-5)19(14-9-4)16-12-7-2/h10,17H,5-9,11-16,20H2,1-4H3.
What are the key properties of N,N'-dibutyl-1-ethenylsilyl-N,N'-dipropylmethanediamine?
N,N'-dibutyl-1-ethenylsilyl-N,N'-dipropylmethanediamine has a molecular weight of 298.59 g/mol, XLogP of 3.61, 14 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dibutyl-1-ethenylsilyl-N,N'-dipropylmethanediamine is sourced from PubChem (CID 123785851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).