N,N-dibenzyl-3-[ethenyl(dimethyl)silyl]propan-1-amine

C21H29NSi — CID 68781079

IUPACN,N-dibenzyl-3-[ethenyl(dimethyl)silyl]propan-1-amine
SMILESC=C[Si](C)(C)CCCN(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C21H29NSi/c1-4-23(2,3)17-11-16-22(18-20-12-7-5-8-13-20)19-21-14-9-6-10-15-21/h4-10,12-15H,1,11,16-19H2,2-3H3
InChIKeyHBOHPRVASOXZGB-UHFFFAOYSA-N
MW323.56 g/mol
LogP5.51
Rot. Bonds9

About N,N-dibenzyl-3-[ethenyl(dimethyl)silyl]propan-1-amine

N,N-dibenzyl-3-[ethenyl(dimethyl)silyl]propan-1-amine (PubChem CID 68781079) has the molecular formula C21H29NSi and a molecular weight of 323.56 g/mol. Its IUPAC name is N,N-dibenzyl-3-[ethenyl(dimethyl)silyl]propan-1-amine.

Molecular Properties

Compound NameN,N-dibenzyl-3-[ethenyl(dimethyl)silyl]propan-1-amine
PubChem CID68781079
Molecular FormulaC21H29NSi
Molecular Weight323.56 g/mol
Exact Mass323.21
IUPAC NameN,N-dibenzyl-3-[ethenyl(dimethyl)silyl]propan-1-amine
SMILESC=C[Si](C)(C)CCCN(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C21H29NSi/c1-4-23(2,3)17-11-16-22(18-20-12-7-5-8-13-20)19-21-14-9-6-10-15-21/h4-10,12-15H,1,11,16-19H2,2-3H3
InChIKeyHBOHPRVASOXZGB-UHFFFAOYSA-N
XLogP5.51
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500323.56
LogP ≤ 55.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N,N-dibenzyl-3-[ethenyl(dimethyl)silyl]propan-1-amine?
The IUPAC name of N,N-dibenzyl-3-[ethenyl(dimethyl)silyl]propan-1-amine (CID 68781079) is N,N-dibenzyl-3-[ethenyl(dimethyl)silyl]propan-1-amine.
What is the SMILES notation for N,N-dibenzyl-3-[ethenyl(dimethyl)silyl]propan-1-amine?
The canonical SMILES for N,N-dibenzyl-3-[ethenyl(dimethyl)silyl]propan-1-amine is C=C[Si](C)(C)CCCN(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of N,N-dibenzyl-3-[ethenyl(dimethyl)silyl]propan-1-amine?
The InChIKey is HBOHPRVASOXZGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29NSi/c1-4-23(2,3)17-11-16-22(18-20-12-7-5-8-13-20)19-21-14-9-6-10-15-21/h4-10,12-15H,1,11,16-19H2,2-3H3.
What are the key properties of N,N-dibenzyl-3-[ethenyl(dimethyl)silyl]propan-1-amine?
N,N-dibenzyl-3-[ethenyl(dimethyl)silyl]propan-1-amine has a molecular weight of 323.56 g/mol, XLogP of 5.51, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzyl-3-[ethenyl(dimethyl)silyl]propan-1-amine is sourced from PubChem (CID 68781079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).