8,8,14,14-tetramethyl-11-pyridin-2-yl-1λ5-phospha-8,14-disilapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene 1-oxide

C27H26NOPSi2 — CID 156655386

IUPAC8,8,14,14-tetramethyl-11-pyridin-2-yl-1λ5-phospha-8,14-disilapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene 1-oxide
SMILESC[Si]1(C)c2ccccc2P2(=O)c3ccccc3[Si](C)(C)c3cc(-c4ccccn4)cc1c32
InChIInChI=1S/C27H26NOPSi2/c1-31(2)23-14-7-5-12-21(23)30(29)22-13-6-8-15-24(22)32(3,4)26-18-19(17-25(31)27(26)30)20-11-9-10-16-28-20/h5-18H,1-4H3
InChIKeyKFTNMYJSSVXSFY-UHFFFAOYSA-N
MW467.66 g/mol
LogP2.66
Rot. Bonds1

About 8,8,14,14-tetramethyl-11-pyridin-2-yl-1λ5-phospha-8,14-disilapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene 1-oxide

8,8,14,14-tetramethyl-11-pyridin-2-yl-1λ5-phospha-8,14-disilapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene 1-oxide (PubChem CID 156655386) has the molecular formula C27H26NOPSi2 and a molecular weight of 467.66 g/mol. Its IUPAC name is 8,8,14,14-tetramethyl-11-pyridin-2-yl-1λ5-phospha-8,14-disilapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene 1-oxide.

Molecular Properties

Compound Name8,8,14,14-tetramethyl-11-pyridin-2-yl-1λ5-phospha-8,14-disilapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene 1-oxide
PubChem CID156655386
Molecular FormulaC27H26NOPSi2
Molecular Weight467.66 g/mol
Exact Mass467.13
IUPAC Name8,8,14,14-tetramethyl-11-pyridin-2-yl-1λ5-phospha-8,14-disilapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene 1-oxide
SMILESC[Si]1(C)c2ccccc2P2(=O)c3ccccc3[Si](C)(C)c3cc(-c4ccccn4)cc1c32
InChIInChI=1S/C27H26NOPSi2/c1-31(2)23-14-7-5-12-21(23)30(29)22-13-6-8-15-24(22)32(3,4)26-18-19(17-25(31)27(26)30)20-11-9-10-16-28-20/h5-18H,1-4H3
InChIKeyKFTNMYJSSVXSFY-UHFFFAOYSA-N
XLogP2.66
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.66
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 8,8,14,14-tetramethyl-11-pyridin-2-yl-1λ5-phospha-8,14-disilapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene 1-oxide with MolForge

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Related Compounds

CID 156655640
CID 156655640
8,8,14,14-tetramethyl-11-pyridin-2-yl-1λ5-phosphapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene 1-oxide
CID 156655217
2-[3-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)phenyl]pyridine
CID 153423347
2-[3-[3-(3,5-dipyridin-2-ylphenyl)-5-methylphenyl]-5-pyridin-2-ylphenyl]pyridine
CID 58556429
2-[3-[2-[2-(3,5-dipyridin-2-ylphenyl)phenyl]phenyl]-5-pyridin-2-ylphenyl]pyridine
CID 71534257
5-oxo-5-propyl-2-(3-pyridin-2-ylphenyl)phosphindolo[3,2-b]pyridin-9-ol
CID 153499099
7-(4,6-diphenyl-1,3,5-triazin-2-yl)-10,10,21,21-tetramethyl-14-phenyl-14λ5-phospha-10,21-disilapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4(9),5,7,11,15,17,19-nonaene 14-oxide
CID 153292041
1-N,1-N,3-N,3-N-tetramethyl-5-pyridin-2-ylbenzene-1,3-diamine
CID 102138084
2-[3,5-bis[6-(3-pyridin-2-ylphenyl)-2-pyridinyl]phenyl]-6-(3-pyridin-2-ylphenyl)pyridine
CID 102128660
2-phenylpyridine;propan-2-one
CID 174845023
2,6-difluoro-4-pyridin-2-ylbenzoic acid
CID 176582239
trimethyl-(3-pyridin-2-ylphenyl)silane
CID 140721406

Frequently Asked Questions

What is the IUPAC name of 8,8,14,14-tetramethyl-11-pyridin-2-yl-1λ5-phospha-8,14-disilapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene 1-oxide?
The IUPAC name of 8,8,14,14-tetramethyl-11-pyridin-2-yl-1λ5-phospha-8,14-disilapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene 1-oxide (CID 156655386) is 8,8,14,14-tetramethyl-11-pyridin-2-yl-1λ5-phospha-8,14-disilapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene 1-oxide.
What is the SMILES notation for 8,8,14,14-tetramethyl-11-pyridin-2-yl-1λ5-phospha-8,14-disilapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene 1-oxide?
The canonical SMILES for 8,8,14,14-tetramethyl-11-pyridin-2-yl-1λ5-phospha-8,14-disilapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene 1-oxide is C[Si]1(C)c2ccccc2P2(=O)c3ccccc3[Si](C)(C)c3cc(-c4ccccn4)cc1c32.
What is the InChIKey of 8,8,14,14-tetramethyl-11-pyridin-2-yl-1λ5-phospha-8,14-disilapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene 1-oxide?
The InChIKey is KFTNMYJSSVXSFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H26NOPSi2/c1-31(2)23-14-7-5-12-21(23)30(29)22-13-6-8-15-24(22)32(3,4)26-18-19(17-25(31)27(26)30)20-11-9-10-16-28-20/h5-18H,1-4H3.
What are the key properties of 8,8,14,14-tetramethyl-11-pyridin-2-yl-1λ5-phospha-8,14-disilapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene 1-oxide?
8,8,14,14-tetramethyl-11-pyridin-2-yl-1λ5-phospha-8,14-disilapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene 1-oxide has a molecular weight of 467.66 g/mol, XLogP of 2.66, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8,8,14,14-tetramethyl-11-pyridin-2-yl-1λ5-phospha-8,14-disilapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene 1-oxide is sourced from PubChem (CID 156655386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).