8-azatricyclo[10.4.0.02,7]hexadeca-3,5,8,11,13,15-hexaene

C15H15N — CID 54068551

IUPAC8-azatricyclo[10.4.0.02,7]hexadeca-3,5,8,11,13,15-hexaene
SMILESC1=CC2=CC/C=N\C3C=CC=CC3C2C=C1
InChIInChI=1S/C15H15N/c1-2-8-13-12(6-1)7-5-11-16-15-10-4-3-9-14(13)15/h1-4,6-11,13-15H,5H2/b12-7?,16-11-
InChIKeyMETQQNRBBBCART-KBYDIJCVSA-N
MW209.29 g/mol
LogP3.24
Rot. Bonds

About 8-azatricyclo[10.4.0.02,7]hexadeca-3,5,8,11,13,15-hexaene

8-azatricyclo[10.4.0.02,7]hexadeca-3,5,8,11,13,15-hexaene (PubChem CID 54068551) has the molecular formula C15H15N and a molecular weight of 209.29 g/mol. Its IUPAC name is 8-azatricyclo[10.4.0.02,7]hexadeca-3,5,8,11,13,15-hexaene.

Molecular Properties

Compound Name8-azatricyclo[10.4.0.02,7]hexadeca-3,5,8,11,13,15-hexaene
PubChem CID54068551
Molecular FormulaC15H15N
Molecular Weight209.29 g/mol
Exact Mass209.12
IUPAC Name8-azatricyclo[10.4.0.02,7]hexadeca-3,5,8,11,13,15-hexaene
SMILESC1=CC2=CC/C=N\C3C=CC=CC3C2C=C1
InChIInChI=1S/C15H15N/c1-2-8-13-12(6-1)7-5-11-16-15-10-4-3-9-14(13)15/h1-4,6-11,13-15H,5H2/b12-7?,16-11-
InChIKeyMETQQNRBBBCART-KBYDIJCVSA-N
XLogP3.24
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 8-azatricyclo[10.4.0.02,7]hexadeca-3,5,8,11,13,15-hexaene with MolForge

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Related Compounds

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CID 123941003
3-ethyl-5-fluoro-3a,7a-dihydro-3H-indole
CID 91299299
(10aR,10bS)-10a,10b-dihydrobenzo[h]quinoline
CID 134855711
4-Azatricyclo[9.4.0.03,8]pentadeca-1,4,6,10,12,14-hexaene
CID 18187422
(4aS,8aS)-3,4,4a,8a-tetrahydroquinoline
CID 53824787
4,5,5a,9a-tetrahydro-3H-2-benzazepine
CID 53961654
3,4,4a,8a-Tetrahydroquinoline
CID 54092524
2,5,5a,9a-tetrahydro-1H-3-benzazepine
CID 54189236
4,5,5a,9a-tetrahydro-3H-1-benzazepine
CID 54378898
4,5,5a,9a-tetrahydro-1H-2-benzazepine
CID 54443574
2,5,9,9a-tetrahydro-1H-3-benzazepine
CID 54493788
(8aS)-3,4,4a,8a-tetrahydroquinoline
CID 56628707

Frequently Asked Questions

What is the IUPAC name of 8-azatricyclo[10.4.0.02,7]hexadeca-3,5,8,11,13,15-hexaene?
The IUPAC name of 8-azatricyclo[10.4.0.02,7]hexadeca-3,5,8,11,13,15-hexaene (CID 54068551) is 8-azatricyclo[10.4.0.02,7]hexadeca-3,5,8,11,13,15-hexaene.
What is the SMILES notation for 8-azatricyclo[10.4.0.02,7]hexadeca-3,5,8,11,13,15-hexaene?
The canonical SMILES for 8-azatricyclo[10.4.0.02,7]hexadeca-3,5,8,11,13,15-hexaene is C1=CC2=CC/C=N\C3C=CC=CC3C2C=C1.
What is the InChIKey of 8-azatricyclo[10.4.0.02,7]hexadeca-3,5,8,11,13,15-hexaene?
The InChIKey is METQQNRBBBCART-KBYDIJCVSA-N. The full InChI is InChI=1S/C15H15N/c1-2-8-13-12(6-1)7-5-11-16-15-10-4-3-9-14(13)15/h1-4,6-11,13-15H,5H2/b12-7?,16-11-.
What are the key properties of 8-azatricyclo[10.4.0.02,7]hexadeca-3,5,8,11,13,15-hexaene?
8-azatricyclo[10.4.0.02,7]hexadeca-3,5,8,11,13,15-hexaene has a molecular weight of 209.29 g/mol, XLogP of 3.24, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-azatricyclo[10.4.0.02,7]hexadeca-3,5,8,11,13,15-hexaene is sourced from PubChem (CID 54068551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).