2-[tert-butyl(diphenyl)silyl]oxypropan-1-amine

C19H27NOSi — CID 57092304

IUPAC2-[tert-butyl(diphenyl)silyl]oxypropan-1-amine
SMILESCC(CN)O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C19H27NOSi/c1-16(15-20)21-22(19(2,3)4,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,16H,15,20H2,1-4H3
InChIKeyTZZZMSQQCFPPIY-UHFFFAOYSA-N
MW313.52 g/mol
LogP2.91
Rot. Bonds5

About 2-[tert-butyl(diphenyl)silyl]oxypropan-1-amine

2-[tert-butyl(diphenyl)silyl]oxypropan-1-amine (PubChem CID 57092304) has the molecular formula C19H27NOSi and a molecular weight of 313.52 g/mol. Its IUPAC name is 2-[tert-butyl(diphenyl)silyl]oxypropan-1-amine.

Molecular Properties

Compound Name2-[tert-butyl(diphenyl)silyl]oxypropan-1-amine
PubChem CID57092304
Molecular FormulaC19H27NOSi
Molecular Weight313.52 g/mol
Exact Mass313.19
IUPAC Name2-[tert-butyl(diphenyl)silyl]oxypropan-1-amine
SMILESCC(CN)O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C19H27NOSi/c1-16(15-20)21-22(19(2,3)4,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,16H,15,20H2,1-4H3
InChIKeyTZZZMSQQCFPPIY-UHFFFAOYSA-N
XLogP2.91
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.52
LogP ≤ 52.91
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 2-[tert-butyl(diphenyl)silyl]oxypropan-1-amine?
The IUPAC name of 2-[tert-butyl(diphenyl)silyl]oxypropan-1-amine (CID 57092304) is 2-[tert-butyl(diphenyl)silyl]oxypropan-1-amine.
What is the SMILES notation for 2-[tert-butyl(diphenyl)silyl]oxypropan-1-amine?
The canonical SMILES for 2-[tert-butyl(diphenyl)silyl]oxypropan-1-amine is CC(CN)O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.
What is the InChIKey of 2-[tert-butyl(diphenyl)silyl]oxypropan-1-amine?
The InChIKey is TZZZMSQQCFPPIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27NOSi/c1-16(15-20)21-22(19(2,3)4,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,16H,15,20H2,1-4H3.
What are the key properties of 2-[tert-butyl(diphenyl)silyl]oxypropan-1-amine?
2-[tert-butyl(diphenyl)silyl]oxypropan-1-amine has a molecular weight of 313.52 g/mol, XLogP of 2.91, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[tert-butyl(diphenyl)silyl]oxypropan-1-amine is sourced from PubChem (CID 57092304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).