triethyl-[(5-methoxy-2-phenylindazol-3-yl)methoxy]silane

C21H28N2O2Si — CID 11428628

IUPACtriethyl-[(5-methoxy-2-phenylindazol-3-yl)methoxy]silane
SMILESCC[Si](CC)(CC)OCc1c2cc(OC)ccc2nn1-c1ccccc1
InChIInChI=1S/C21H28N2O2Si/c1-5-26(6-2,7-3)25-16-21-19-15-18(24-4)13-14-20(19)22-23(21)17-11-9-8-10-12-17/h8-15H,5-7,16H2,1-4H3
InChIKeyWMPQWOJOWBLRIP-UHFFFAOYSA-N
MW368.55 g/mol
LogP5.56
Rot. Bonds8

About triethyl-[(5-methoxy-2-phenylindazol-3-yl)methoxy]silane

triethyl-[(5-methoxy-2-phenylindazol-3-yl)methoxy]silane (PubChem CID 11428628) has the molecular formula C21H28N2O2Si and a molecular weight of 368.55 g/mol. Its IUPAC name is triethyl-[(5-methoxy-2-phenylindazol-3-yl)methoxy]silane.

Molecular Properties

Compound Nametriethyl-[(5-methoxy-2-phenylindazol-3-yl)methoxy]silane
PubChem CID11428628
Molecular FormulaC21H28N2O2Si
Molecular Weight368.55 g/mol
Exact Mass368.19
IUPAC Nametriethyl-[(5-methoxy-2-phenylindazol-3-yl)methoxy]silane
SMILESCC[Si](CC)(CC)OCc1c2cc(OC)ccc2nn1-c1ccccc1
InChIInChI=1S/C21H28N2O2Si/c1-5-26(6-2,7-3)25-16-21-19-15-18(24-4)13-14-20(19)22-23(21)17-11-9-8-10-12-17/h8-15H,5-7,16H2,1-4H3
InChIKeyWMPQWOJOWBLRIP-UHFFFAOYSA-N
XLogP5.56
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.55
LogP ≤ 55.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 triethyl-[(5-methoxy-2-phenylindazol-3-yl)methoxy]silane?
The IUPAC name of triethyl-[(5-methoxy-2-phenylindazol-3-yl)methoxy]silane (CID 11428628) is triethyl-[(5-methoxy-2-phenylindazol-3-yl)methoxy]silane.
What is the SMILES notation for triethyl-[(5-methoxy-2-phenylindazol-3-yl)methoxy]silane?
The canonical SMILES for triethyl-[(5-methoxy-2-phenylindazol-3-yl)methoxy]silane is CC[Si](CC)(CC)OCc1c2cc(OC)ccc2nn1-c1ccccc1.
What is the InChIKey of triethyl-[(5-methoxy-2-phenylindazol-3-yl)methoxy]silane?
The InChIKey is WMPQWOJOWBLRIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N2O2Si/c1-5-26(6-2,7-3)25-16-21-19-15-18(24-4)13-14-20(19)22-23(21)17-11-9-8-10-12-17/h8-15H,5-7,16H2,1-4H3.
What are the key properties of triethyl-[(5-methoxy-2-phenylindazol-3-yl)methoxy]silane?
triethyl-[(5-methoxy-2-phenylindazol-3-yl)methoxy]silane has a molecular weight of 368.55 g/mol, XLogP of 5.56, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(5-methoxy-2-phenylindazol-3-yl)methoxy]silane is sourced from PubChem (CID 11428628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).