N,N-diethyl-3-(3-methylbut-2-enylsilyl)propan-1-amine

C12H27NSi — CID 173072555

IUPACN,N-diethyl-3-(3-methylbut-2-enylsilyl)propan-1-amine
SMILESCCN(CC)CCC[SiH2]CC=C(C)C
InChIInChI=1S/C12H27NSi/c1-5-13(6-2)9-7-10-14-11-8-12(3)4/h8H,5-7,9-11,14H2,1-4H3
InChIKeyXENMOKZPZFJAEI-UHFFFAOYSA-N
MW213.44 g/mol
LogP2.69
Rot. Bonds8

About N,N-diethyl-3-(3-methylbut-2-enylsilyl)propan-1-amine

N,N-diethyl-3-(3-methylbut-2-enylsilyl)propan-1-amine (PubChem CID 173072555) has the molecular formula C12H27NSi and a molecular weight of 213.44 g/mol. Its IUPAC name is N,N-diethyl-3-(3-methylbut-2-enylsilyl)propan-1-amine.

Molecular Properties

Compound NameN,N-diethyl-3-(3-methylbut-2-enylsilyl)propan-1-amine
PubChem CID173072555
Molecular FormulaC12H27NSi
Molecular Weight213.44 g/mol
Exact Mass213.19
IUPAC NameN,N-diethyl-3-(3-methylbut-2-enylsilyl)propan-1-amine
SMILESCCN(CC)CCC[SiH2]CC=C(C)C
InChIInChI=1S/C12H27NSi/c1-5-13(6-2)9-7-10-14-11-8-12(3)4/h8H,5-7,9-11,14H2,1-4H3
InChIKeyXENMOKZPZFJAEI-UHFFFAOYSA-N
XLogP2.69
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.44
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-butyl-N-(3-methylbut-2-enylsilylmethyl)butan-1-amine
CID 173072690
N,N-diethyl-3-(2-methylprop-1-enylsilyl)propan-1-amine
CID 154087974
N,N-diethyl-4-methylpent-3-en-1-amine
CID 12610282
bis(3-(diethylamino)propan-1-ol);zirconium
CID 158788459
N-methyl-N-(3-methylbut-2-enylsilyl)ethanamine
CID 174048144
(E)-N,N-diethylheptadec-9-en-1-amine
CID 102116407
(E)-N,N-diethylheptadec-4-en-1-amine
CID 102116402
12-(diethylamino)dodec-1-en-1-ol
CID 142764006
N',N'-diethylpropane-1,3-diamine;docosane
CID 174486105
(Z)-4-[3-(diethylamino)propyl-ethylamino]-2-methylbut-2-enoic acid
CID 102994735
N,N-diethylicos-9-ene-1,20-diamine
CID 154402145
tetrakis(N,N-diethylbutan-1-amine);ethane;methane
CID 157434901

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-(3-methylbut-2-enylsilyl)propan-1-amine?
The IUPAC name of N,N-diethyl-3-(3-methylbut-2-enylsilyl)propan-1-amine (CID 173072555) is N,N-diethyl-3-(3-methylbut-2-enylsilyl)propan-1-amine.
What is the SMILES notation for N,N-diethyl-3-(3-methylbut-2-enylsilyl)propan-1-amine?
The canonical SMILES for N,N-diethyl-3-(3-methylbut-2-enylsilyl)propan-1-amine is CCN(CC)CCC[SiH2]CC=C(C)C.
What is the InChIKey of N,N-diethyl-3-(3-methylbut-2-enylsilyl)propan-1-amine?
The InChIKey is XENMOKZPZFJAEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27NSi/c1-5-13(6-2)9-7-10-14-11-8-12(3)4/h8H,5-7,9-11,14H2,1-4H3.
What are the key properties of N,N-diethyl-3-(3-methylbut-2-enylsilyl)propan-1-amine?
N,N-diethyl-3-(3-methylbut-2-enylsilyl)propan-1-amine has a molecular weight of 213.44 g/mol, XLogP of 2.69, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-(3-methylbut-2-enylsilyl)propan-1-amine is sourced from PubChem (CID 173072555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).