N-ethyl-4-fluoro-2-trimethylsilylnaphthalene-1-carboxamide

C16H20FNOSi — CID 15457428

IUPACN-ethyl-4-fluoro-2-trimethylsilylnaphthalene-1-carboxamide
SMILESCCNC(=O)c1c([Si](C)(C)C)cc(F)c2ccccc12
InChIInChI=1S/C16H20FNOSi/c1-5-18-16(19)15-12-9-7-6-8-11(12)13(17)10-14(15)20(2,3)4/h6-10H,5H2,1-4H3,(H,18,19)
InChIKeyLRSKJJMWWCTQEY-UHFFFAOYSA-N
MW289.43 g/mol
LogP3.27
Rot. Bonds3

About N-ethyl-4-fluoro-2-trimethylsilylnaphthalene-1-carboxamide

N-ethyl-4-fluoro-2-trimethylsilylnaphthalene-1-carboxamide (PubChem CID 15457428) has the molecular formula C16H20FNOSi and a molecular weight of 289.43 g/mol. Its IUPAC name is N-ethyl-4-fluoro-2-trimethylsilylnaphthalene-1-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-fluoro-2-trimethylsilylnaphthalene-1-carboxamide
PubChem CID15457428
Molecular FormulaC16H20FNOSi
Molecular Weight289.43 g/mol
Exact Mass289.13
IUPAC NameN-ethyl-4-fluoro-2-trimethylsilylnaphthalene-1-carboxamide
SMILESCCNC(=O)c1c([Si](C)(C)C)cc(F)c2ccccc12
InChIInChI=1S/C16H20FNOSi/c1-5-18-16(19)15-12-9-7-6-8-11(12)13(17)10-14(15)20(2,3)4/h6-10H,5H2,1-4H3,(H,18,19)
InChIKeyLRSKJJMWWCTQEY-UHFFFAOYSA-N
XLogP3.27
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.43
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-3-trimethylsilylnaphthalene-2-carboxamide
CID 19602324
N-ethyl-5-trimethylsilyl-1-benzothiophene-4-carboxamide
CID 22071491
N-ethyl-6-trimethylsilyl-1-benzofuran-7-carboxamide
CID 22071496
5-benzamido-N-ethyl-2-trimethylsilylbenzamide
CID 18630031
N-ethylbenzamide
CID 160772566
N-ethyl-2-(5-fluoroquinolin-3-yl)benzamide
CID 155510016
N-ethyl-5-methylsulfanyl-3-trimethylsilylthiophene-2-carboxamide
CID 12039968
5-(dimethylamino)-N-ethyl-2-trimethylsilylbenzamide
CID 18630068
2-chloro-N-ethyl-6-[ethyl(dimethyl)silyl]benzamide
CID 18630286
N-ethyl-2-(ethylamino)-3-fluorobenzamide
CID 62648907
N-ethyl-4-fluoro-3-hydroxybenzamide
CID 130057561
N-ethylbenzamide;hydrochloride
CID 57444995

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-fluoro-2-trimethylsilylnaphthalene-1-carboxamide?
The IUPAC name of N-ethyl-4-fluoro-2-trimethylsilylnaphthalene-1-carboxamide (CID 15457428) is N-ethyl-4-fluoro-2-trimethylsilylnaphthalene-1-carboxamide.
What is the SMILES notation for N-ethyl-4-fluoro-2-trimethylsilylnaphthalene-1-carboxamide?
The canonical SMILES for N-ethyl-4-fluoro-2-trimethylsilylnaphthalene-1-carboxamide is CCNC(=O)c1c([Si](C)(C)C)cc(F)c2ccccc12.
What is the InChIKey of N-ethyl-4-fluoro-2-trimethylsilylnaphthalene-1-carboxamide?
The InChIKey is LRSKJJMWWCTQEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FNOSi/c1-5-18-16(19)15-12-9-7-6-8-11(12)13(17)10-14(15)20(2,3)4/h6-10H,5H2,1-4H3,(H,18,19).
What are the key properties of N-ethyl-4-fluoro-2-trimethylsilylnaphthalene-1-carboxamide?
N-ethyl-4-fluoro-2-trimethylsilylnaphthalene-1-carboxamide has a molecular weight of 289.43 g/mol, XLogP of 3.27, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-fluoro-2-trimethylsilylnaphthalene-1-carboxamide is sourced from PubChem (CID 15457428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).