2-[2-tri(propan-2-yl)silyloxyethyl]benzohydrazide

C18H32N2O2Si — CID 177468032

IUPAC2-[2-tri(propan-2-yl)silyloxyethyl]benzohydrazide
SMILESCC(C)[Si](OCCc1ccccc1C(=O)NN)(C(C)C)C(C)C
InChIInChI=1S/C18H32N2O2Si/c1-13(2)23(14(3)4,15(5)6)22-12-11-16-9-7-8-10-17(16)18(21)20-19/h7-10,13-15H,11-12,19H2,1-6H3,(H,20,21)
InChIKeyXWBCYJIFHSANFF-UHFFFAOYSA-N
MW336.55 g/mol
LogP4.02
Rot. Bonds8

About 2-[2-tri(propan-2-yl)silyloxyethyl]benzohydrazide

2-[2-tri(propan-2-yl)silyloxyethyl]benzohydrazide (PubChem CID 177468032) has the molecular formula C18H32N2O2Si and a molecular weight of 336.55 g/mol. Its IUPAC name is 2-[2-tri(propan-2-yl)silyloxyethyl]benzohydrazide.

Molecular Properties

Compound Name2-[2-tri(propan-2-yl)silyloxyethyl]benzohydrazide
PubChem CID177468032
Molecular FormulaC18H32N2O2Si
Molecular Weight336.55 g/mol
Exact Mass336.22
IUPAC Name2-[2-tri(propan-2-yl)silyloxyethyl]benzohydrazide
SMILESCC(C)[Si](OCCc1ccccc1C(=O)NN)(C(C)C)C(C)C
InChIInChI=1S/C18H32N2O2Si/c1-13(2)23(14(3)4,15(5)6)22-12-11-16-9-7-8-10-17(16)18(21)20-19/h7-10,13-15H,11-12,19H2,1-6H3,(H,20,21)
InChIKeyXWBCYJIFHSANFF-UHFFFAOYSA-N
XLogP4.02
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.55
LogP ≤ 54.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-[2-tri(propan-2-yl)silyloxyethyl]benzohydrazide?
The IUPAC name of 2-[2-tri(propan-2-yl)silyloxyethyl]benzohydrazide (CID 177468032) is 2-[2-tri(propan-2-yl)silyloxyethyl]benzohydrazide.
What is the SMILES notation for 2-[2-tri(propan-2-yl)silyloxyethyl]benzohydrazide?
The canonical SMILES for 2-[2-tri(propan-2-yl)silyloxyethyl]benzohydrazide is CC(C)[Si](OCCc1ccccc1C(=O)NN)(C(C)C)C(C)C.
What is the InChIKey of 2-[2-tri(propan-2-yl)silyloxyethyl]benzohydrazide?
The InChIKey is XWBCYJIFHSANFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2O2Si/c1-13(2)23(14(3)4,15(5)6)22-12-11-16-9-7-8-10-17(16)18(21)20-19/h7-10,13-15H,11-12,19H2,1-6H3,(H,20,21).
What are the key properties of 2-[2-tri(propan-2-yl)silyloxyethyl]benzohydrazide?
2-[2-tri(propan-2-yl)silyloxyethyl]benzohydrazide has a molecular weight of 336.55 g/mol, XLogP of 4.02, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-tri(propan-2-yl)silyloxyethyl]benzohydrazide is sourced from PubChem (CID 177468032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).