2-amino-5-methoxy-N-(5-trimethylsilyl-2-pyridinyl)benzamide

C16H21N3O2Si — CID 89316590

IUPAC2-amino-5-methoxy-N-(5-trimethylsilyl-2-pyridinyl)benzamide
SMILESCOc1ccc(N)c(C(=O)Nc2ccc([Si](C)(C)C)cn2)c1
InChIInChI=1S/C16H21N3O2Si/c1-21-11-5-7-14(17)13(9-11)16(20)19-15-8-6-12(10-18-15)22(2,3)4/h5-10H,17H2,1-4H3,(H,18,19,20)
InChIKeyBGRZLEKYFPQVSX-UHFFFAOYSA-N
MW315.45 g/mol
LogP2.47
Rot. Bonds4

About 2-amino-5-methoxy-N-(5-trimethylsilyl-2-pyridinyl)benzamide

2-amino-5-methoxy-N-(5-trimethylsilyl-2-pyridinyl)benzamide (PubChem CID 89316590) has the molecular formula C16H21N3O2Si and a molecular weight of 315.45 g/mol. Its IUPAC name is 2-amino-5-methoxy-N-(5-trimethylsilyl-2-pyridinyl)benzamide.

Molecular Properties

Compound Name2-amino-5-methoxy-N-(5-trimethylsilyl-2-pyridinyl)benzamide
PubChem CID89316590
Molecular FormulaC16H21N3O2Si
Molecular Weight315.45 g/mol
Exact Mass315.14
IUPAC Name2-amino-5-methoxy-N-(5-trimethylsilyl-2-pyridinyl)benzamide
SMILESCOc1ccc(N)c(C(=O)Nc2ccc([Si](C)(C)C)cn2)c1
InChIInChI=1S/C16H21N3O2Si/c1-21-11-5-7-14(17)13(9-11)16(20)19-15-8-6-12(10-18-15)22(2,3)4/h5-10H,17H2,1-4H3,(H,18,19,20)
InChIKeyBGRZLEKYFPQVSX-UHFFFAOYSA-N
XLogP2.47
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.45
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-methoxy-N-(5-trimethylsilyl-2-pyridinyl)benzamide?
The IUPAC name of 2-amino-5-methoxy-N-(5-trimethylsilyl-2-pyridinyl)benzamide (CID 89316590) is 2-amino-5-methoxy-N-(5-trimethylsilyl-2-pyridinyl)benzamide.
What is the SMILES notation for 2-amino-5-methoxy-N-(5-trimethylsilyl-2-pyridinyl)benzamide?
The canonical SMILES for 2-amino-5-methoxy-N-(5-trimethylsilyl-2-pyridinyl)benzamide is COc1ccc(N)c(C(=O)Nc2ccc([Si](C)(C)C)cn2)c1.
What is the InChIKey of 2-amino-5-methoxy-N-(5-trimethylsilyl-2-pyridinyl)benzamide?
The InChIKey is BGRZLEKYFPQVSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2Si/c1-21-11-5-7-14(17)13(9-11)16(20)19-15-8-6-12(10-18-15)22(2,3)4/h5-10H,17H2,1-4H3,(H,18,19,20).
What are the key properties of 2-amino-5-methoxy-N-(5-trimethylsilyl-2-pyridinyl)benzamide?
2-amino-5-methoxy-N-(5-trimethylsilyl-2-pyridinyl)benzamide has a molecular weight of 315.45 g/mol, XLogP of 2.47, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-methoxy-N-(5-trimethylsilyl-2-pyridinyl)benzamide is sourced from PubChem (CID 89316590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).