N,N-diethyl-3-[fluoro(dimethyl)silyl]-2-methyl-3-phenylpropanamide

C16H26FNOSi — CID 10017419

IUPACN,N-diethyl-3-[fluoro(dimethyl)silyl]-2-methyl-3-phenylpropanamide
SMILESCCN(CC)C(=O)C(C)C(c1ccccc1)[Si](C)(C)F
InChIInChI=1S/C16H26FNOSi/c1-6-18(7-2)16(19)13(3)15(20(4,5)17)14-11-9-8-10-12-14/h8-13,15H,6-7H2,1-5H3
InChIKeyUOPGQYAPKIOSHN-UHFFFAOYSA-N
MW295.47 g/mol
LogP3.99
Rot. Bonds6

About N,N-diethyl-3-[fluoro(dimethyl)silyl]-2-methyl-3-phenylpropanamide

N,N-diethyl-3-[fluoro(dimethyl)silyl]-2-methyl-3-phenylpropanamide (PubChem CID 10017419) has the molecular formula C16H26FNOSi and a molecular weight of 295.47 g/mol. Its IUPAC name is N,N-diethyl-3-[fluoro(dimethyl)silyl]-2-methyl-3-phenylpropanamide.

Molecular Properties

Compound NameN,N-diethyl-3-[fluoro(dimethyl)silyl]-2-methyl-3-phenylpropanamide
PubChem CID10017419
Molecular FormulaC16H26FNOSi
Molecular Weight295.47 g/mol
Exact Mass295.18
IUPAC NameN,N-diethyl-3-[fluoro(dimethyl)silyl]-2-methyl-3-phenylpropanamide
SMILESCCN(CC)C(=O)C(C)C(c1ccccc1)[Si](C)(C)F
InChIInChI=1S/C16H26FNOSi/c1-6-18(7-2)16(19)13(3)15(20(4,5)17)14-11-9-8-10-12-14/h8-13,15H,6-7H2,1-5H3
InChIKeyUOPGQYAPKIOSHN-UHFFFAOYSA-N
XLogP3.99
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.47
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N,N-Diethyl-2-phenylacetamide
CID 17076
AI3-37157
CID 760213
AI3-37156
CID 897567
N-cyclohexyl-N-ethyl-3-phenylpropanamide
CID 670110
3-Phenyl-1-(pyrrolidin-1-yl)propan-1-one
CID 1533088
N,N-diethyl-2,2-diphenylacetamide
CID 229107
1-Methyl-5-phenyl-piperidin-2-one
CID 12012176
2-(4-fluorophenyl)-N,N-dipropylacetamide
CID 1121963
1-(2-Ethylpiperidin-1-yl)-4-phenylbutan-1-one
CID 2914757
2-phenyl-N,N-di(propan-2-yl)butanamide
CID 3747942
N-isopentyl-4-phenylbutanamide
CID 1725703
N-(2-methylpropyl)-4-phenylbutanamide
CID 2906742

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-[fluoro(dimethyl)silyl]-2-methyl-3-phenylpropanamide?
The IUPAC name of N,N-diethyl-3-[fluoro(dimethyl)silyl]-2-methyl-3-phenylpropanamide (CID 10017419) is N,N-diethyl-3-[fluoro(dimethyl)silyl]-2-methyl-3-phenylpropanamide.
What is the SMILES notation for N,N-diethyl-3-[fluoro(dimethyl)silyl]-2-methyl-3-phenylpropanamide?
The canonical SMILES for N,N-diethyl-3-[fluoro(dimethyl)silyl]-2-methyl-3-phenylpropanamide is CCN(CC)C(=O)C(C)C(c1ccccc1)[Si](C)(C)F.
What is the InChIKey of N,N-diethyl-3-[fluoro(dimethyl)silyl]-2-methyl-3-phenylpropanamide?
The InChIKey is UOPGQYAPKIOSHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26FNOSi/c1-6-18(7-2)16(19)13(3)15(20(4,5)17)14-11-9-8-10-12-14/h8-13,15H,6-7H2,1-5H3.
What are the key properties of N,N-diethyl-3-[fluoro(dimethyl)silyl]-2-methyl-3-phenylpropanamide?
N,N-diethyl-3-[fluoro(dimethyl)silyl]-2-methyl-3-phenylpropanamide has a molecular weight of 295.47 g/mol, XLogP of 3.99, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-[fluoro(dimethyl)silyl]-2-methyl-3-phenylpropanamide is sourced from PubChem (CID 10017419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).