N,6-dimethyl-4-oxo-N-(trimethylsilylmethyl)-1H-pyridine-3-carboxamide

C12H20N2O2Si — CID 154765821

IUPACN,6-dimethyl-4-oxo-N-(trimethylsilylmethyl)-1H-pyridine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)N(C)C[Si](C)(C)C)c[nH]1
InChIInChI=1S/C12H20N2O2Si/c1-9-6-11(15)10(7-13-9)12(16)14(2)8-17(3,4)5/h6-7H,8H2,1-5H3,(H,13,15)
InChIKeyGQKUJRBAOBPAAP-UHFFFAOYSA-N
MW252.39 g/mol
LogP1.63
Rot. Bonds3

About N,6-dimethyl-4-oxo-N-(trimethylsilylmethyl)-1H-pyridine-3-carboxamide

N,6-dimethyl-4-oxo-N-(trimethylsilylmethyl)-1H-pyridine-3-carboxamide (PubChem CID 154765821) has the molecular formula C12H20N2O2Si and a molecular weight of 252.39 g/mol. Its IUPAC name is N,6-dimethyl-4-oxo-N-(trimethylsilylmethyl)-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN,6-dimethyl-4-oxo-N-(trimethylsilylmethyl)-1H-pyridine-3-carboxamide
PubChem CID154765821
Molecular FormulaC12H20N2O2Si
Molecular Weight252.39 g/mol
Exact Mass252.13
IUPAC NameN,6-dimethyl-4-oxo-N-(trimethylsilylmethyl)-1H-pyridine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)N(C)C[Si](C)(C)C)c[nH]1
InChIInChI=1S/C12H20N2O2Si/c1-9-6-11(15)10(7-13-9)12(16)14(2)8-17(3,4)5/h6-7H,8H2,1-5H3,(H,13,15)
InChIKeyGQKUJRBAOBPAAP-UHFFFAOYSA-N
XLogP1.63
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.39
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 N,6-dimethyl-4-oxo-N-(trimethylsilylmethyl)-1H-pyridine-3-carboxamide?
The IUPAC name of N,6-dimethyl-4-oxo-N-(trimethylsilylmethyl)-1H-pyridine-3-carboxamide (CID 154765821) is N,6-dimethyl-4-oxo-N-(trimethylsilylmethyl)-1H-pyridine-3-carboxamide.
What is the SMILES notation for N,6-dimethyl-4-oxo-N-(trimethylsilylmethyl)-1H-pyridine-3-carboxamide?
The canonical SMILES for N,6-dimethyl-4-oxo-N-(trimethylsilylmethyl)-1H-pyridine-3-carboxamide is Cc1cc(=O)c(C(=O)N(C)C[Si](C)(C)C)c[nH]1.
What is the InChIKey of N,6-dimethyl-4-oxo-N-(trimethylsilylmethyl)-1H-pyridine-3-carboxamide?
The InChIKey is GQKUJRBAOBPAAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2Si/c1-9-6-11(15)10(7-13-9)12(16)14(2)8-17(3,4)5/h6-7H,8H2,1-5H3,(H,13,15).
What are the key properties of N,6-dimethyl-4-oxo-N-(trimethylsilylmethyl)-1H-pyridine-3-carboxamide?
N,6-dimethyl-4-oxo-N-(trimethylsilylmethyl)-1H-pyridine-3-carboxamide has a molecular weight of 252.39 g/mol, XLogP of 1.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-4-oxo-N-(trimethylsilylmethyl)-1H-pyridine-3-carboxamide is sourced from PubChem (CID 154765821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).