1,9-dimethyl-4-aza-1-silatetracyclo[6.5.2.04,15.011,14]pentadeca-8(15),9,11(14)-triene

C15H21NSi — CID 177102475

IUPAC1,9-dimethyl-4-aza-1-silatetracyclo[6.5.2.04,15.011,14]pentadeca-8(15),9,11(14)-triene
SMILESCc1cc2c3c4c1CCCN4CC[Si]3(C)CC2
InChIInChI=1S/C15H21NSi/c1-11-10-12-5-8-17(2)9-7-16-6-3-4-13(11)14(16)15(12)17/h10H,3-9H2,1-2H3
InChIKeyUEALQFRERACJNX-UHFFFAOYSA-N
MW243.43 g/mol
LogP2.60
Rot. Bonds

About 1,9-dimethyl-4-aza-1-silatetracyclo[6.5.2.04,15.011,14]pentadeca-8(15),9,11(14)-triene

1,9-dimethyl-4-aza-1-silatetracyclo[6.5.2.04,15.011,14]pentadeca-8(15),9,11(14)-triene (PubChem CID 177102475) has the molecular formula C15H21NSi and a molecular weight of 243.43 g/mol. Its IUPAC name is 1,9-dimethyl-4-aza-1-silatetracyclo[6.5.2.04,15.011,14]pentadeca-8(15),9,11(14)-triene.

Molecular Properties

Compound Name1,9-dimethyl-4-aza-1-silatetracyclo[6.5.2.04,15.011,14]pentadeca-8(15),9,11(14)-triene
PubChem CID177102475
Molecular FormulaC15H21NSi
Molecular Weight243.43 g/mol
Exact Mass243.14
IUPAC Name1,9-dimethyl-4-aza-1-silatetracyclo[6.5.2.04,15.011,14]pentadeca-8(15),9,11(14)-triene
SMILESCc1cc2c3c4c1CCCN4CC[Si]3(C)CC2
InChIInChI=1S/C15H21NSi/c1-11-10-12-5-8-17(2)9-7-16-6-3-4-13(11)14(16)15(12)17/h10H,3-9H2,1-2H3
InChIKeyUEALQFRERACJNX-UHFFFAOYSA-N
XLogP2.60
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.43
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,4,9-trimethyl-4-silatetracyclo[6.5.2.04,15.011,14]pentadeca-8(15),9,11(14)-triene
CID 177102366
6,7,8-trimethyl-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene
CID 21029067
7-iodo-6-methyl-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene
CID 146667407
6-butoxy-7-methyl-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene
CID 129169310
7-methyl-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene-6,8-diol
CID 122580532
7-bromo-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene;hydrobromide
CID 21161176
7-ethyl-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene
CID 70876138
8-methyl-4-azatricyclo[5.3.1.04,11]undeca-1(11),7,9-triene
CID 177102462
ethyl 6-hydroxy-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene-7-carboxylate
CID 170871983
6,8-dimethoxy-7-methyl-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene
CID 150976400
1-azatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-triene-6-carboxylic acid
CID 116993414
6-fluoro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene
CID 138981773

Frequently Asked Questions

What is the IUPAC name of 1,9-dimethyl-4-aza-1-silatetracyclo[6.5.2.04,15.011,14]pentadeca-8(15),9,11(14)-triene?
The IUPAC name of 1,9-dimethyl-4-aza-1-silatetracyclo[6.5.2.04,15.011,14]pentadeca-8(15),9,11(14)-triene (CID 177102475) is 1,9-dimethyl-4-aza-1-silatetracyclo[6.5.2.04,15.011,14]pentadeca-8(15),9,11(14)-triene.
What is the SMILES notation for 1,9-dimethyl-4-aza-1-silatetracyclo[6.5.2.04,15.011,14]pentadeca-8(15),9,11(14)-triene?
The canonical SMILES for 1,9-dimethyl-4-aza-1-silatetracyclo[6.5.2.04,15.011,14]pentadeca-8(15),9,11(14)-triene is Cc1cc2c3c4c1CCCN4CC[Si]3(C)CC2.
What is the InChIKey of 1,9-dimethyl-4-aza-1-silatetracyclo[6.5.2.04,15.011,14]pentadeca-8(15),9,11(14)-triene?
The InChIKey is UEALQFRERACJNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NSi/c1-11-10-12-5-8-17(2)9-7-16-6-3-4-13(11)14(16)15(12)17/h10H,3-9H2,1-2H3.
What are the key properties of 1,9-dimethyl-4-aza-1-silatetracyclo[6.5.2.04,15.011,14]pentadeca-8(15),9,11(14)-triene?
1,9-dimethyl-4-aza-1-silatetracyclo[6.5.2.04,15.011,14]pentadeca-8(15),9,11(14)-triene has a molecular weight of 243.43 g/mol, XLogP of 2.60, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,9-dimethyl-4-aza-1-silatetracyclo[6.5.2.04,15.011,14]pentadeca-8(15),9,11(14)-triene is sourced from PubChem (CID 177102475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).