3-(2,2-dimethyl-3,3-diphenyloxadisilinan-6-yl)propan-1-amine

C20H29NOSi2 — CID 174867095

IUPAC3-(2,2-dimethyl-3,3-diphenyloxadisilinan-6-yl)propan-1-amine
SMILESC[Si]1(C)OC(CCCN)CC[Si]1(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H29NOSi2/c1-23(2)22-18(10-9-16-21)15-17-24(23,19-11-5-3-6-12-19)20-13-7-4-8-14-20/h3-8,11-14,18H,9-10,15-17,21H2,1-2H3
InChIKeyIVXXADNDAFPRMZ-UHFFFAOYSA-N
MW355.63 g/mol
LogP3.06
Rot. Bonds5

About 3-(2,2-dimethyl-3,3-diphenyloxadisilinan-6-yl)propan-1-amine

3-(2,2-dimethyl-3,3-diphenyloxadisilinan-6-yl)propan-1-amine (PubChem CID 174867095) has the molecular formula C20H29NOSi2 and a molecular weight of 355.63 g/mol. Its IUPAC name is 3-(2,2-dimethyl-3,3-diphenyloxadisilinan-6-yl)propan-1-amine.

Molecular Properties

Compound Name3-(2,2-dimethyl-3,3-diphenyloxadisilinan-6-yl)propan-1-amine
PubChem CID174867095
Molecular FormulaC20H29NOSi2
Molecular Weight355.63 g/mol
Exact Mass355.18
IUPAC Name3-(2,2-dimethyl-3,3-diphenyloxadisilinan-6-yl)propan-1-amine
SMILESC[Si]1(C)OC(CCCN)CC[Si]1(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H29NOSi2/c1-23(2)22-18(10-9-16-21)15-17-24(23,19-11-5-3-6-12-19)20-13-7-4-8-14-20/h3-8,11-14,18H,9-10,15-17,21H2,1-2H3
InChIKeyIVXXADNDAFPRMZ-UHFFFAOYSA-N
XLogP3.06
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.63
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 3-(2,2-dimethyl-3,3-diphenyloxadisilinan-6-yl)propan-1-amine?
The IUPAC name of 3-(2,2-dimethyl-3,3-diphenyloxadisilinan-6-yl)propan-1-amine (CID 174867095) is 3-(2,2-dimethyl-3,3-diphenyloxadisilinan-6-yl)propan-1-amine.
What is the SMILES notation for 3-(2,2-dimethyl-3,3-diphenyloxadisilinan-6-yl)propan-1-amine?
The canonical SMILES for 3-(2,2-dimethyl-3,3-diphenyloxadisilinan-6-yl)propan-1-amine is C[Si]1(C)OC(CCCN)CC[Si]1(c1ccccc1)c1ccccc1.
What is the InChIKey of 3-(2,2-dimethyl-3,3-diphenyloxadisilinan-6-yl)propan-1-amine?
The InChIKey is IVXXADNDAFPRMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29NOSi2/c1-23(2)22-18(10-9-16-21)15-17-24(23,19-11-5-3-6-12-19)20-13-7-4-8-14-20/h3-8,11-14,18H,9-10,15-17,21H2,1-2H3.
What are the key properties of 3-(2,2-dimethyl-3,3-diphenyloxadisilinan-6-yl)propan-1-amine?
3-(2,2-dimethyl-3,3-diphenyloxadisilinan-6-yl)propan-1-amine has a molecular weight of 355.63 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2-dimethyl-3,3-diphenyloxadisilinan-6-yl)propan-1-amine is sourced from PubChem (CID 174867095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).