8-azatetracyclo[6.6.1.02,7.011,15]pentadeca-1(14),2,4,11(15),12-pentaene;dimethylsilane;methane

C17H25NSi — CID 157326875

IUPAC8-azatetracyclo[6.6.1.02,7.011,15]pentadeca-1(14),2,4,11(15),12-pentaene;dimethylsilane;methane
SMILESC.C1=CCC2C(=C1)c1cccc3c1N2CC3.C[SiH2]C
InChIInChI=1S/C14H13N.C2H8Si.CH4/c1-2-7-13-11(5-1)12-6-3-4-10-8-9-15(13)14(10)12;1-3-2;/h1-6,13H,7-9H2;3H2,1-2H3;1H4
InChIKeyBEVGQKIGSQWTLX-UHFFFAOYSA-N
MW271.48 g/mol
LogP3.66
Rot. Bonds

About 8-azatetracyclo[6.6.1.02,7.011,15]pentadeca-1(14),2,4,11(15),12-pentaene;dimethylsilane;methane

8-azatetracyclo[6.6.1.02,7.011,15]pentadeca-1(14),2,4,11(15),12-pentaene;dimethylsilane;methane (PubChem CID 157326875) has the molecular formula C17H25NSi and a molecular weight of 271.48 g/mol. Its IUPAC name is 8-azatetracyclo[6.6.1.02,7.011,15]pentadeca-1(14),2,4,11(15),12-pentaene;dimethylsilane;methane.

Molecular Properties

Compound Name8-azatetracyclo[6.6.1.02,7.011,15]pentadeca-1(14),2,4,11(15),12-pentaene;dimethylsilane;methane
PubChem CID157326875
Molecular FormulaC17H25NSi
Molecular Weight271.48 g/mol
Exact Mass271.18
IUPAC Name8-azatetracyclo[6.6.1.02,7.011,15]pentadeca-1(14),2,4,11(15),12-pentaene;dimethylsilane;methane
SMILESC.C1=CCC2C(=C1)c1cccc3c1N2CC3.C[SiH2]C
InChIInChI=1S/C14H13N.C2H8Si.CH4/c1-2-7-13-11(5-1)12-6-3-4-10-8-9-15(13)14(10)12;1-3-2;/h1-6,13H,7-9H2;3H2,1-2H3;1H4
InChIKeyBEVGQKIGSQWTLX-UHFFFAOYSA-N
XLogP3.66
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.48
LogP ≤ 53.66
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

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CID 90847264
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4-azatricyclo[5.3.1.04,11]undeca-1(11),7,9-triene
CID 15498114
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CID 155006098
10-bromo-1,12b-dihydrotriphenylene
CID 145063923
9-(5-methylcyclohexa-1,5-dien-1-yl)-1,9,10,10a-tetrahydrophenanthrene
CID 123504389
ethane;(2-naphthalen-1-ylcyclohexa-2,4-dien-1-yl)boronic acid
CID 143742417
1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8(19),9,11,13,15-octaen-4-ylboronic acid
CID 165160975
2-(5,6-dihydronaphthalen-1-yl)-1-(4-methylphenyl)-7,7a-dihydroindole
CID 152971116
5-methyl-9H-benzo[7]annulene
CID 123648201
3-(7-tert-butyl-2,3-dihydroindol-1-yl)-6-methylidenepiperidin-2-one
CID 170079417
N,1-dimethyl-2,3-dihydroindol-7-amine
CID 22943239

Frequently Asked Questions

What is the IUPAC name of 8-azatetracyclo[6.6.1.02,7.011,15]pentadeca-1(14),2,4,11(15),12-pentaene;dimethylsilane;methane?
The IUPAC name of 8-azatetracyclo[6.6.1.02,7.011,15]pentadeca-1(14),2,4,11(15),12-pentaene;dimethylsilane;methane (CID 157326875) is 8-azatetracyclo[6.6.1.02,7.011,15]pentadeca-1(14),2,4,11(15),12-pentaene;dimethylsilane;methane.
What is the SMILES notation for 8-azatetracyclo[6.6.1.02,7.011,15]pentadeca-1(14),2,4,11(15),12-pentaene;dimethylsilane;methane?
The canonical SMILES for 8-azatetracyclo[6.6.1.02,7.011,15]pentadeca-1(14),2,4,11(15),12-pentaene;dimethylsilane;methane is C.C1=CCC2C(=C1)c1cccc3c1N2CC3.C[SiH2]C.
What is the InChIKey of 8-azatetracyclo[6.6.1.02,7.011,15]pentadeca-1(14),2,4,11(15),12-pentaene;dimethylsilane;methane?
The InChIKey is BEVGQKIGSQWTLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N.C2H8Si.CH4/c1-2-7-13-11(5-1)12-6-3-4-10-8-9-15(13)14(10)12;1-3-2;/h1-6,13H,7-9H2;3H2,1-2H3;1H4.
What are the key properties of 8-azatetracyclo[6.6.1.02,7.011,15]pentadeca-1(14),2,4,11(15),12-pentaene;dimethylsilane;methane?
8-azatetracyclo[6.6.1.02,7.011,15]pentadeca-1(14),2,4,11(15),12-pentaene;dimethylsilane;methane has a molecular weight of 271.48 g/mol, XLogP of 3.66, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-azatetracyclo[6.6.1.02,7.011,15]pentadeca-1(14),2,4,11(15),12-pentaene;dimethylsilane;methane is sourced from PubChem (CID 157326875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).