N-(tert-butyl-propan-2-yl-propylsilyl)-N-ethylethanamine

C14H33NSi — CID 87363605

IUPACN-(tert-butyl-propan-2-yl-propylsilyl)-N-ethylethanamine
SMILESCCC[Si](C(C)C)(N(CC)CC)C(C)(C)C
InChIInChI=1S/C14H33NSi/c1-9-12-16(13(4)5,14(6,7)8)15(10-2)11-3/h13H,9-12H2,1-8H3
InChIKeyVGCLEYXKQTYWDN-UHFFFAOYSA-N
MW243.51 g/mol
LogP4.89
Rot. Bonds6

About N-(tert-butyl-propan-2-yl-propylsilyl)-N-ethylethanamine

N-(tert-butyl-propan-2-yl-propylsilyl)-N-ethylethanamine (PubChem CID 87363605) has the molecular formula C14H33NSi and a molecular weight of 243.51 g/mol. Its IUPAC name is N-(tert-butyl-propan-2-yl-propylsilyl)-N-ethylethanamine.

Molecular Properties

Compound NameN-(tert-butyl-propan-2-yl-propylsilyl)-N-ethylethanamine
PubChem CID87363605
Molecular FormulaC14H33NSi
Molecular Weight243.51 g/mol
Exact Mass243.24
IUPAC NameN-(tert-butyl-propan-2-yl-propylsilyl)-N-ethylethanamine
SMILESCCC[Si](C(C)C)(N(CC)CC)C(C)(C)C
InChIInChI=1S/C14H33NSi/c1-9-12-16(13(4)5,14(6,7)8)15(10-2)11-3/h13H,9-12H2,1-8H3
InChIKeyVGCLEYXKQTYWDN-UHFFFAOYSA-N
XLogP4.89
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.51
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(tert-butyl-propan-2-yl-propylsilyl)-N-ethylethanamine?
The IUPAC name of N-(tert-butyl-propan-2-yl-propylsilyl)-N-ethylethanamine (CID 87363605) is N-(tert-butyl-propan-2-yl-propylsilyl)-N-ethylethanamine.
What is the SMILES notation for N-(tert-butyl-propan-2-yl-propylsilyl)-N-ethylethanamine?
The canonical SMILES for N-(tert-butyl-propan-2-yl-propylsilyl)-N-ethylethanamine is CCC[Si](C(C)C)(N(CC)CC)C(C)(C)C.
What is the InChIKey of N-(tert-butyl-propan-2-yl-propylsilyl)-N-ethylethanamine?
The InChIKey is VGCLEYXKQTYWDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H33NSi/c1-9-12-16(13(4)5,14(6,7)8)15(10-2)11-3/h13H,9-12H2,1-8H3.
What are the key properties of N-(tert-butyl-propan-2-yl-propylsilyl)-N-ethylethanamine?
N-(tert-butyl-propan-2-yl-propylsilyl)-N-ethylethanamine has a molecular weight of 243.51 g/mol, XLogP of 4.89, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(tert-butyl-propan-2-yl-propylsilyl)-N-ethylethanamine is sourced from PubChem (CID 87363605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).