N-(6-chloro-3-trimethylsilyl-2-pyridinyl)-2,2-dimethylpropanamide

C13H21ClN2OSi — CID 88957514

IUPACN-(6-chloro-3-trimethylsilyl-2-pyridinyl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1nc(Cl)ccc1[Si](C)(C)C
InChIInChI=1S/C13H21ClN2OSi/c1-13(2,3)12(17)16-11-9(18(4,5)6)7-8-10(14)15-11/h7-8H,1-6H3,(H,15,16,17)
InChIKeyQRBVNJZIJZKUDT-UHFFFAOYSA-N
MW284.86 g/mol
LogP3.26
Rot. Bonds2

About N-(6-chloro-3-trimethylsilyl-2-pyridinyl)-2,2-dimethylpropanamide

N-(6-chloro-3-trimethylsilyl-2-pyridinyl)-2,2-dimethylpropanamide (PubChem CID 88957514) has the molecular formula C13H21ClN2OSi and a molecular weight of 284.86 g/mol. Its IUPAC name is N-(6-chloro-3-trimethylsilyl-2-pyridinyl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(6-chloro-3-trimethylsilyl-2-pyridinyl)-2,2-dimethylpropanamide
PubChem CID88957514
Molecular FormulaC13H21ClN2OSi
Molecular Weight284.86 g/mol
Exact Mass284.11
IUPAC NameN-(6-chloro-3-trimethylsilyl-2-pyridinyl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1nc(Cl)ccc1[Si](C)(C)C
InChIInChI=1S/C13H21ClN2OSi/c1-13(2,3)12(17)16-11-9(18(4,5)6)7-8-10(14)15-11/h7-8H,1-6H3,(H,15,16,17)
InChIKeyQRBVNJZIJZKUDT-UHFFFAOYSA-N
XLogP3.26
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.86
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

N-[6-chloro-3-[(R)-methylsulfinyl]-2-pyridinyl]-2,2-dimethylpropanamide
CID 169098775
2,2-dimethyl-N-(3-trimethylsilyl-2-pyridinyl)propanamide
CID 15914609
methyl 3-[6-chloro-2-(2,2-dimethylpropanoylamino)-3-pyridinyl]-3-hydroxy-2,2-dimethylpropanoate
CID 87825426
N-(4-bromo-6-chloropyridazin-3-yl)-2,2-dimethylpropanamide
CID 127119625
N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-2,2-dimethylpropanamide
CID 90246038
2,2-dimethyl-N-(4-methyl-7-oxa-3-azabicyclo[4.1.0]hepta-1(6),2,4-trien-2-yl)propanamide
CID 141245355
N-(6-chloro-4-methyl-2-pyridinyl)-2,2-dimethylpropanamide
CID 59165851
N-(2-chloro-4-pyridinyl)-2,2-dimethylpropanamide
CID 58398271
N-(5-chloropyrazin-2-yl)-2,2-dimethylpropanamide
CID 107595750
N-(6-chloro-5-ethyl-2-pyridinyl)-2,2-dimethylpropanamide
CID 59272532
N-isoquinolin-1-yl-2,2-dimethylpropanamide
CID 598735
2,2-dimethyl-N-(3-methyl-2-pyridinyl)propanamide
CID 1479965

Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-3-trimethylsilyl-2-pyridinyl)-2,2-dimethylpropanamide?
The IUPAC name of N-(6-chloro-3-trimethylsilyl-2-pyridinyl)-2,2-dimethylpropanamide (CID 88957514) is N-(6-chloro-3-trimethylsilyl-2-pyridinyl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(6-chloro-3-trimethylsilyl-2-pyridinyl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(6-chloro-3-trimethylsilyl-2-pyridinyl)-2,2-dimethylpropanamide is CC(C)(C)C(=O)Nc1nc(Cl)ccc1[Si](C)(C)C.
What is the InChIKey of N-(6-chloro-3-trimethylsilyl-2-pyridinyl)-2,2-dimethylpropanamide?
The InChIKey is QRBVNJZIJZKUDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21ClN2OSi/c1-13(2,3)12(17)16-11-9(18(4,5)6)7-8-10(14)15-11/h7-8H,1-6H3,(H,15,16,17).
What are the key properties of N-(6-chloro-3-trimethylsilyl-2-pyridinyl)-2,2-dimethylpropanamide?
N-(6-chloro-3-trimethylsilyl-2-pyridinyl)-2,2-dimethylpropanamide has a molecular weight of 284.86 g/mol, XLogP of 3.26, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-3-trimethylsilyl-2-pyridinyl)-2,2-dimethylpropanamide is sourced from PubChem (CID 88957514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).