tert-butyl-dimethyl-[(1-prop-2-ynylcyclobutyl)methoxy]silane

C14H26OSi — CID 165342832

IUPACtert-butyl-dimethyl-[(1-prop-2-ynylcyclobutyl)methoxy]silane
SMILESC#CCC1(CO[Si](C)(C)C(C)(C)C)CCC1
InChIInChI=1S/C14H26OSi/c1-7-9-14(10-8-11-14)12-15-16(5,6)13(2,3)4/h1H,8-12H2,2-6H3
InChIKeyRAICWSVKLMRSKY-UHFFFAOYSA-N
MW238.45 g/mol
LogP4.20
Rot. Bonds4

About tert-butyl-dimethyl-[(1-prop-2-ynylcyclobutyl)methoxy]silane

tert-butyl-dimethyl-[(1-prop-2-ynylcyclobutyl)methoxy]silane (PubChem CID 165342832) has the molecular formula C14H26OSi and a molecular weight of 238.45 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(1-prop-2-ynylcyclobutyl)methoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(1-prop-2-ynylcyclobutyl)methoxy]silane
PubChem CID165342832
Molecular FormulaC14H26OSi
Molecular Weight238.45 g/mol
Exact Mass238.18
IUPAC Nametert-butyl-dimethyl-[(1-prop-2-ynylcyclobutyl)methoxy]silane
SMILESC#CCC1(CO[Si](C)(C)C(C)(C)C)CCC1
InChIInChI=1S/C14H26OSi/c1-7-9-14(10-8-11-14)12-15-16(5,6)13(2,3)4/h1H,8-12H2,2-6H3
InChIKeyRAICWSVKLMRSKY-UHFFFAOYSA-N
XLogP4.20
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.45
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(1-prop-2-ynylcyclobutyl)methoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[(1-prop-2-ynylcyclobutyl)methoxy]silane (CID 165342832) is tert-butyl-dimethyl-[(1-prop-2-ynylcyclobutyl)methoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(1-prop-2-ynylcyclobutyl)methoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[(1-prop-2-ynylcyclobutyl)methoxy]silane is C#CCC1(CO[Si](C)(C)C(C)(C)C)CCC1.
What is the InChIKey of tert-butyl-dimethyl-[(1-prop-2-ynylcyclobutyl)methoxy]silane?
The InChIKey is RAICWSVKLMRSKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26OSi/c1-7-9-14(10-8-11-14)12-15-16(5,6)13(2,3)4/h1H,8-12H2,2-6H3.
What are the key properties of tert-butyl-dimethyl-[(1-prop-2-ynylcyclobutyl)methoxy]silane?
tert-butyl-dimethyl-[(1-prop-2-ynylcyclobutyl)methoxy]silane has a molecular weight of 238.45 g/mol, XLogP of 4.20, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(1-prop-2-ynylcyclobutyl)methoxy]silane is sourced from PubChem (CID 165342832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).