CID 23561708

C23H26F6N2O2Si2 — CID 23561708

IUPAC—
SMILESCN(C(=O)C(C(=O)N(C)c1cccc([Si](C)C)c1)(C(F)(F)F)C(F)(F)F)c1cccc([Si](C)C)c1
InChIInChI=1S/C23H26F6N2O2Si2/c1-30(15-9-7-11-17(13-15)34(3)4)19(32)21(22(24,25)26,23(27,28)29)20(33)31(2)16-10-8-12-18(14-16)35(5)6/h7-14H,1-6H3
InChIKeyPRQJPQOANMJQJV-UHFFFAOYSA-N
MW532.63 g/mol
LogP4.35
Rot. Bonds6

About CID 23561708

CID 23561708 (PubChem CID 23561708) has the molecular formula C23H26F6N2O2Si2 and a molecular weight of 532.63 g/mol.

Molecular Properties

Compound NameCID 23561708
PubChem CID23561708
Molecular FormulaC23H26F6N2O2Si2
Molecular Weight532.63 g/mol
Exact Mass532.14
IUPAC Name—
SMILESCN(C(=O)C(C(=O)N(C)c1cccc([Si](C)C)c1)(C(F)(F)F)C(F)(F)F)c1cccc([Si](C)C)c1
InChIInChI=1S/C23H26F6N2O2Si2/c1-30(15-9-7-11-17(13-15)34(3)4)19(32)21(22(24,25)26,23(27,28)29)20(33)31(2)16-10-8-12-18(14-16)35(5)6/h7-14H,1-6H3
InChIKeyPRQJPQOANMJQJV-UHFFFAOYSA-N
XLogP4.35
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500532.63
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

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N-(3-bromophenyl)-N,2,2-trimethylpropanamide
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2-amino-N-(3-hydroxyphenyl)-N,2-dimethylpropanamide
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1-[3-[methyl-(2,2,2-trifluoroacetyl)amino]phenyl]propyl 2,2,2-trifluoroacetate
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2,2,2-trifluoro-N-methyl-N-(3-prop-2-enoxyphenyl)acetamide
CID 91684287
N-[3-(1,3-benzothiazol-2-yl)phenyl]-2,2,2-trifluoro-N-methylacetamide
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N-[4-(dimethylamino)phenyl]-2,2,2-trifluoro-N-methylacetamide
CID 91720800
3-(3-methoxy-N-methylanilino)-2,2-dimethyl-3-oxopropanoic acid
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Frequently Asked Questions

What is the IUPAC name of CID 23561708?
The IUPAC name of CID 23561708 (CID 23561708) is not available.
What is the SMILES notation for CID 23561708?
The canonical SMILES for CID 23561708 is CN(C(=O)C(C(=O)N(C)c1cccc([Si](C)C)c1)(C(F)(F)F)C(F)(F)F)c1cccc([Si](C)C)c1.
What is the InChIKey of CID 23561708?
The InChIKey is PRQJPQOANMJQJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26F6N2O2Si2/c1-30(15-9-7-11-17(13-15)34(3)4)19(32)21(22(24,25)26,23(27,28)29)20(33)31(2)16-10-8-12-18(14-16)35(5)6/h7-14H,1-6H3.
What are the key properties of CID 23561708?
CID 23561708 has a molecular weight of 532.63 g/mol, XLogP of 4.35, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 23561708 is sourced from PubChem (CID 23561708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).