(3Z)-N,N-diethyl-3-(2-phenyl-2-trimethylsilylethylidene)nonanamide

C24H41NOSi — CID 101369149

IUPAC(3Z)-N,N-diethyl-3-(2-phenyl-2-trimethylsilylethylidene)nonanamide
SMILESCCCCCC/C(=C/C(c1ccccc1)[Si](C)(C)C)CC(=O)N(CC)CC
InChIInChI=1S/C24H41NOSi/c1-7-10-11-13-16-21(20-24(26)25(8-2)9-3)19-23(27(4,5)6)22-17-14-12-15-18-22/h12,14-15,17-19,23H,7-11,13,16,20H2,1-6H3/b21-19-
InChIKeyIXXBFOQZGLTYLE-VZCXRCSSSA-N
MW387.68 g/mol
LogP6.80
Rot. Bonds12

About (3Z)-N,N-diethyl-3-(2-phenyl-2-trimethylsilylethylidene)nonanamide

(3Z)-N,N-diethyl-3-(2-phenyl-2-trimethylsilylethylidene)nonanamide (PubChem CID 101369149) has the molecular formula C24H41NOSi and a molecular weight of 387.68 g/mol. Its IUPAC name is (3Z)-N,N-diethyl-3-(2-phenyl-2-trimethylsilylethylidene)nonanamide.

Molecular Properties

Compound Name(3Z)-N,N-diethyl-3-(2-phenyl-2-trimethylsilylethylidene)nonanamide
PubChem CID101369149
Molecular FormulaC24H41NOSi
Molecular Weight387.68 g/mol
Exact Mass387.30
IUPAC Name(3Z)-N,N-diethyl-3-(2-phenyl-2-trimethylsilylethylidene)nonanamide
SMILESCCCCCC/C(=C/C(c1ccccc1)[Si](C)(C)C)CC(=O)N(CC)CC
InChIInChI=1S/C24H41NOSi/c1-7-10-11-13-16-21(20-24(26)25(8-2)9-3)19-23(27(4,5)6)22-17-14-12-15-18-22/h12,14-15,17-19,23H,7-11,13,16,20H2,1-6H3/b21-19-
InChIKeyIXXBFOQZGLTYLE-VZCXRCSSSA-N
XLogP6.80
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.68
LogP ≤ 56.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3Z)-N,N-diethyl-3-(2-phenyl-2-trimethylsilylethylidene)nonanamide?
The IUPAC name of (3Z)-N,N-diethyl-3-(2-phenyl-2-trimethylsilylethylidene)nonanamide (CID 101369149) is (3Z)-N,N-diethyl-3-(2-phenyl-2-trimethylsilylethylidene)nonanamide.
What is the SMILES notation for (3Z)-N,N-diethyl-3-(2-phenyl-2-trimethylsilylethylidene)nonanamide?
The canonical SMILES for (3Z)-N,N-diethyl-3-(2-phenyl-2-trimethylsilylethylidene)nonanamide is CCCCCC/C(=C/C(c1ccccc1)[Si](C)(C)C)CC(=O)N(CC)CC.
What is the InChIKey of (3Z)-N,N-diethyl-3-(2-phenyl-2-trimethylsilylethylidene)nonanamide?
The InChIKey is IXXBFOQZGLTYLE-VZCXRCSSSA-N. The full InChI is InChI=1S/C24H41NOSi/c1-7-10-11-13-16-21(20-24(26)25(8-2)9-3)19-23(27(4,5)6)22-17-14-12-15-18-22/h12,14-15,17-19,23H,7-11,13,16,20H2,1-6H3/b21-19-.
What are the key properties of (3Z)-N,N-diethyl-3-(2-phenyl-2-trimethylsilylethylidene)nonanamide?
(3Z)-N,N-diethyl-3-(2-phenyl-2-trimethylsilylethylidene)nonanamide has a molecular weight of 387.68 g/mol, XLogP of 6.80, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-N,N-diethyl-3-(2-phenyl-2-trimethylsilylethylidene)nonanamide is sourced from PubChem (CID 101369149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).