(13-methyl-4,8-diazatetracyclo[6.6.1.02,7.011,15]pentadeca-1(15),2(7),3,5,9,11,13-heptaen-10-yl)-triphenylsilane

C32H24N2Si — CID 59221941

IUPAC(13-methyl-4,8-diazatetracyclo[6.6.1.02,7.011,15]pentadeca-1(15),2(7),3,5,9,11,13-heptaen-10-yl)-triphenylsilane
SMILESCc1cc2c([Si](c3ccccc3)(c3ccccc3)c3ccccc3)cn3c4ccncc4c(c1)c23
InChIInChI=1S/C32H24N2Si/c1-23-19-27-29-21-33-18-17-30(29)34-22-31(28(20-23)32(27)34)35(24-11-5-2-6-12-24,25-13-7-3-8-14-25)26-15-9-4-10-16-26/h2-22H,1H3
InChIKeyURFJFZDUUCSYJB-UHFFFAOYSA-N
MW464.64 g/mol
LogP4.76
Rot. Bonds4

About (13-methyl-4,8-diazatetracyclo[6.6.1.02,7.011,15]pentadeca-1(15),2(7),3,5,9,11,13-heptaen-10-yl)-triphenylsilane

(13-methyl-4,8-diazatetracyclo[6.6.1.02,7.011,15]pentadeca-1(15),2(7),3,5,9,11,13-heptaen-10-yl)-triphenylsilane (PubChem CID 59221941) has the molecular formula C32H24N2Si and a molecular weight of 464.64 g/mol. Its IUPAC name is (13-methyl-4,8-diazatetracyclo[6.6.1.02,7.011,15]pentadeca-1(15),2(7),3,5,9,11,13-heptaen-10-yl)-triphenylsilane.

Molecular Properties

Compound Name(13-methyl-4,8-diazatetracyclo[6.6.1.02,7.011,15]pentadeca-1(15),2(7),3,5,9,11,13-heptaen-10-yl)-triphenylsilane
PubChem CID59221941
Molecular FormulaC32H24N2Si
Molecular Weight464.64 g/mol
Exact Mass464.17
IUPAC Name(13-methyl-4,8-diazatetracyclo[6.6.1.02,7.011,15]pentadeca-1(15),2(7),3,5,9,11,13-heptaen-10-yl)-triphenylsilane
SMILESCc1cc2c([Si](c3ccccc3)(c3ccccc3)c3ccccc3)cn3c4ccncc4c(c1)c23
InChIInChI=1S/C32H24N2Si/c1-23-19-27-29-21-33-18-17-30(29)34-22-31(28(20-23)32(27)34)35(24-11-5-2-6-12-24,25-13-7-3-8-14-25)26-15-9-4-10-16-26/h2-22H,1H3
InChIKeyURFJFZDUUCSYJB-UHFFFAOYSA-N
XLogP4.76
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500464.64
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze (13-methyl-4,8-diazatetracyclo[6.6.1.02,7.011,15]pentadeca-1(15),2(7),3,5,9,11,13-heptaen-10-yl)-triphenylsilane with MolForge

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Related Compounds

(5-methyl-10-triphenylsilyl-9-thia-1-azatetracyclo[6.5.1.02,7.011,14]tetradeca-2(7),3,5,8(14),10,12-hexaen-12-yl)-triphenylsilane
CID 59221889
(1-methylindol-3-yl)-triphenylsilane
CID 139125439
5-[3-(3,5-diphenylphenyl)-5-methylphenyl]pyrido[4,3-b]indole
CID 143691808
8-(6-methyl-9,10-diphenylanthracen-2-yl)-17-phenyl-13,17-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene
CID 122524562
5-methyl-7-phenylpyrido[4,3-b]indole
CID 155583386
10-pyrido[4,3-b]indol-5-yl-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaene
CID 118517601
ethane;10-[4-(4-phenylphenyl)phenyl]-1,4,16-triazapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13(18),14,16-nonaene
CID 164528208
10-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaene
CID 118517602
8-carbazol-9-yl-5-phenylpyrido[4,3-b]indole
CID 149133438
5-[3-(3,5-diphenylphenyl)-5-methylphenyl]pyrido[4,3-b]indole;ethane;4-methyl-3-(2-methylphenyl)pyridine
CID 143691807
diphenyl-bis(8-phenyl-5,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-4-yl)silane
CID 67988486
4-[2-(2,5,15-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),3,5,7,9,11,14,16-octaen-4-yl)ethyl]-2,5,15-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),3,5,7,9,11,14,16-octaene
CID 58202809

Frequently Asked Questions

What is the IUPAC name of (13-methyl-4,8-diazatetracyclo[6.6.1.02,7.011,15]pentadeca-1(15),2(7),3,5,9,11,13-heptaen-10-yl)-triphenylsilane?
The IUPAC name of (13-methyl-4,8-diazatetracyclo[6.6.1.02,7.011,15]pentadeca-1(15),2(7),3,5,9,11,13-heptaen-10-yl)-triphenylsilane (CID 59221941) is (13-methyl-4,8-diazatetracyclo[6.6.1.02,7.011,15]pentadeca-1(15),2(7),3,5,9,11,13-heptaen-10-yl)-triphenylsilane.
What is the SMILES notation for (13-methyl-4,8-diazatetracyclo[6.6.1.02,7.011,15]pentadeca-1(15),2(7),3,5,9,11,13-heptaen-10-yl)-triphenylsilane?
The canonical SMILES for (13-methyl-4,8-diazatetracyclo[6.6.1.02,7.011,15]pentadeca-1(15),2(7),3,5,9,11,13-heptaen-10-yl)-triphenylsilane is Cc1cc2c([Si](c3ccccc3)(c3ccccc3)c3ccccc3)cn3c4ccncc4c(c1)c23.
What is the InChIKey of (13-methyl-4,8-diazatetracyclo[6.6.1.02,7.011,15]pentadeca-1(15),2(7),3,5,9,11,13-heptaen-10-yl)-triphenylsilane?
The InChIKey is URFJFZDUUCSYJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H24N2Si/c1-23-19-27-29-21-33-18-17-30(29)34-22-31(28(20-23)32(27)34)35(24-11-5-2-6-12-24,25-13-7-3-8-14-25)26-15-9-4-10-16-26/h2-22H,1H3.
What are the key properties of (13-methyl-4,8-diazatetracyclo[6.6.1.02,7.011,15]pentadeca-1(15),2(7),3,5,9,11,13-heptaen-10-yl)-triphenylsilane?
(13-methyl-4,8-diazatetracyclo[6.6.1.02,7.011,15]pentadeca-1(15),2(7),3,5,9,11,13-heptaen-10-yl)-triphenylsilane has a molecular weight of 464.64 g/mol, XLogP of 4.76, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (13-methyl-4,8-diazatetracyclo[6.6.1.02,7.011,15]pentadeca-1(15),2(7),3,5,9,11,13-heptaen-10-yl)-triphenylsilane is sourced from PubChem (CID 59221941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).