N-trimethylsilyl-N-[(E)-(1-trimethylsilylindol-3-yl)methylideneamino]benzamide

C22H29N3OSi2 — CID 91744582

IUPACN-trimethylsilyl-N-[(E)-(1-trimethylsilylindol-3-yl)methylideneamino]benzamide
SMILESC[Si](C)(C)N(/N=C/c1cn([Si](C)(C)C)c2ccccc12)C(=O)c1ccccc1
InChIInChI=1S/C22H29N3OSi2/c1-27(2,3)24-17-19(20-14-10-11-15-21(20)24)16-23-25(28(4,5)6)22(26)18-12-8-7-9-13-18/h7-17H,1-6H3/b23-16+
InChIKeyFLTLUILUIWMOJO-XQNSMLJCSA-N
MW407.67 g/mol
LogP5.64
Rot. Bonds5

About N-trimethylsilyl-N-[(E)-(1-trimethylsilylindol-3-yl)methylideneamino]benzamide

N-trimethylsilyl-N-[(E)-(1-trimethylsilylindol-3-yl)methylideneamino]benzamide (PubChem CID 91744582) has the molecular formula C22H29N3OSi2 and a molecular weight of 407.67 g/mol. Its IUPAC name is N-trimethylsilyl-N-[(E)-(1-trimethylsilylindol-3-yl)methylideneamino]benzamide.

Molecular Properties

Compound NameN-trimethylsilyl-N-[(E)-(1-trimethylsilylindol-3-yl)methylideneamino]benzamide
PubChem CID91744582
Molecular FormulaC22H29N3OSi2
Molecular Weight407.67 g/mol
Exact Mass407.18
IUPAC NameN-trimethylsilyl-N-[(E)-(1-trimethylsilylindol-3-yl)methylideneamino]benzamide
SMILESC[Si](C)(C)N(/N=C/c1cn([Si](C)(C)C)c2ccccc12)C(=O)c1ccccc1
InChIInChI=1S/C22H29N3OSi2/c1-27(2,3)24-17-19(20-14-10-11-15-21(20)24)16-23-25(28(4,5)6)22(26)18-12-8-7-9-13-18/h7-17H,1-6H3/b23-16+
InChIKeyFLTLUILUIWMOJO-XQNSMLJCSA-N
XLogP5.64
TPSA37.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500407.67
LogP ≤ 55.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-trimethylsilyl-N-[(E)-(1-trimethylsilylindol-3-yl)methylideneamino]benzamide?
The IUPAC name of N-trimethylsilyl-N-[(E)-(1-trimethylsilylindol-3-yl)methylideneamino]benzamide (CID 91744582) is N-trimethylsilyl-N-[(E)-(1-trimethylsilylindol-3-yl)methylideneamino]benzamide.
What is the SMILES notation for N-trimethylsilyl-N-[(E)-(1-trimethylsilylindol-3-yl)methylideneamino]benzamide?
The canonical SMILES for N-trimethylsilyl-N-[(E)-(1-trimethylsilylindol-3-yl)methylideneamino]benzamide is C[Si](C)(C)N(/N=C/c1cn([Si](C)(C)C)c2ccccc12)C(=O)c1ccccc1.
What is the InChIKey of N-trimethylsilyl-N-[(E)-(1-trimethylsilylindol-3-yl)methylideneamino]benzamide?
The InChIKey is FLTLUILUIWMOJO-XQNSMLJCSA-N. The full InChI is InChI=1S/C22H29N3OSi2/c1-27(2,3)24-17-19(20-14-10-11-15-21(20)24)16-23-25(28(4,5)6)22(26)18-12-8-7-9-13-18/h7-17H,1-6H3/b23-16+.
What are the key properties of N-trimethylsilyl-N-[(E)-(1-trimethylsilylindol-3-yl)methylideneamino]benzamide?
N-trimethylsilyl-N-[(E)-(1-trimethylsilylindol-3-yl)methylideneamino]benzamide has a molecular weight of 407.67 g/mol, XLogP of 5.64, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-trimethylsilyl-N-[(E)-(1-trimethylsilylindol-3-yl)methylideneamino]benzamide is sourced from PubChem (CID 91744582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).