N,N-diethyl-3-methoxy-6-methyl-2-trimethylsilylbenzamide

C16H27NO2Si — CID 15916001

IUPACN,N-diethyl-3-methoxy-6-methyl-2-trimethylsilylbenzamide
SMILESCCN(CC)C(=O)c1c(C)ccc(OC)c1[Si](C)(C)C
InChIInChI=1S/C16H27NO2Si/c1-8-17(9-2)16(18)14-12(3)10-11-13(19-4)15(14)20(5,6)7/h10-11H,8-9H2,1-7H3
InChIKeyWRDUFOIBCYVFSR-UHFFFAOYSA-N
MW293.48 g/mol
LogP3.03
Rot. Bonds5

About N,N-diethyl-3-methoxy-6-methyl-2-trimethylsilylbenzamide

N,N-diethyl-3-methoxy-6-methyl-2-trimethylsilylbenzamide (PubChem CID 15916001) has the molecular formula C16H27NO2Si and a molecular weight of 293.48 g/mol. Its IUPAC name is N,N-diethyl-3-methoxy-6-methyl-2-trimethylsilylbenzamide.

Molecular Properties

Compound NameN,N-diethyl-3-methoxy-6-methyl-2-trimethylsilylbenzamide
PubChem CID15916001
Molecular FormulaC16H27NO2Si
Molecular Weight293.48 g/mol
Exact Mass293.18
IUPAC NameN,N-diethyl-3-methoxy-6-methyl-2-trimethylsilylbenzamide
SMILESCCN(CC)C(=O)c1c(C)ccc(OC)c1[Si](C)(C)C
InChIInChI=1S/C16H27NO2Si/c1-8-17(9-2)16(18)14-12(3)10-11-13(19-4)15(14)20(5,6)7/h10-11H,8-9H2,1-7H3
InChIKeyWRDUFOIBCYVFSR-UHFFFAOYSA-N
XLogP3.03
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.48
LogP ≤ 53.03
H-Bond Donors ≤ 50
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,N-diethyl-3-methoxy-6-methyl-2-trimethylsilylbenzamide?
The IUPAC name of N,N-diethyl-3-methoxy-6-methyl-2-trimethylsilylbenzamide (CID 15916001) is N,N-diethyl-3-methoxy-6-methyl-2-trimethylsilylbenzamide.
What is the SMILES notation for N,N-diethyl-3-methoxy-6-methyl-2-trimethylsilylbenzamide?
The canonical SMILES for N,N-diethyl-3-methoxy-6-methyl-2-trimethylsilylbenzamide is CCN(CC)C(=O)c1c(C)ccc(OC)c1[Si](C)(C)C.
What is the InChIKey of N,N-diethyl-3-methoxy-6-methyl-2-trimethylsilylbenzamide?
The InChIKey is WRDUFOIBCYVFSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO2Si/c1-8-17(9-2)16(18)14-12(3)10-11-13(19-4)15(14)20(5,6)7/h10-11H,8-9H2,1-7H3.
What are the key properties of N,N-diethyl-3-methoxy-6-methyl-2-trimethylsilylbenzamide?
N,N-diethyl-3-methoxy-6-methyl-2-trimethylsilylbenzamide has a molecular weight of 293.48 g/mol, XLogP of 3.03, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-methoxy-6-methyl-2-trimethylsilylbenzamide is sourced from PubChem (CID 15916001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).