15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(15),2,4,6,8,11,13-heptaene

C14H9N — CID 54107119

IUPAC15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(15),2,4,6,8,11,13-heptaene
SMILESC1=C2N=c3cccc4ccc(c2c34)=CC1
InChIInChI=1S/C14H9N/c1-3-9-7-8-10-4-2-6-12-14(10)13(9)11(5-1)15-12/h1,3-8H,2H2
InChIKeyNENBBNCEYUJHDW-UHFFFAOYSA-N
MW191.23 g/mol
LogP2.00
Rot. Bonds

About 15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(15),2,4,6,8,11,13-heptaene

15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(15),2,4,6,8,11,13-heptaene (PubChem CID 54107119) has the molecular formula C14H9N and a molecular weight of 191.23 g/mol. Its IUPAC name is 15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(15),2,4,6,8,11,13-heptaene.

Molecular Properties

Compound Name15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(15),2,4,6,8,11,13-heptaene
PubChem CID54107119
Molecular FormulaC14H9N
Molecular Weight191.23 g/mol
Exact Mass191.07
IUPAC Name15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(15),2,4,6,8,11,13-heptaene
SMILESC1=C2N=c3cccc4ccc(c2c34)=CC1
InChIInChI=1S/C14H9N/c1-3-9-7-8-10-4-2-6-12-14(10)13(9)11(5-1)15-12/h1,3-8H,2H2
InChIKeyNENBBNCEYUJHDW-UHFFFAOYSA-N
XLogP2.00
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 15897930
4H-Carbazole
CID 19360791
2H-carbazole
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Methyleneindole
CID 20077160
Indoloindole
CID 21887135
Cyclopentacarbazole
CID 21887528
2,3,4,5-tetrahydro-1H-carbazole
CID 22592025
6,12-Dimethylindolo[3,2-b]carbazole
CID 66723768
Dihydroindeno[1,2-b]indole
CID 69302209
Dihydroindolocarbazole
CID 69826808
Dihydroindolo[3,2-b]carbazole
CID 69944640
1H-Benzo(a)carbazole
CID 114645

Frequently Asked Questions

What is the IUPAC name of 15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(15),2,4,6,8,11,13-heptaene?
The IUPAC name of 15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(15),2,4,6,8,11,13-heptaene (CID 54107119) is 15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(15),2,4,6,8,11,13-heptaene.
What is the SMILES notation for 15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(15),2,4,6,8,11,13-heptaene?
The canonical SMILES for 15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(15),2,4,6,8,11,13-heptaene is C1=C2N=c3cccc4ccc(c2c34)=CC1.
What is the InChIKey of 15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(15),2,4,6,8,11,13-heptaene?
The InChIKey is NENBBNCEYUJHDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9N/c1-3-9-7-8-10-4-2-6-12-14(10)13(9)11(5-1)15-12/h1,3-8H,2H2.
What are the key properties of 15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(15),2,4,6,8,11,13-heptaene?
15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(15),2,4,6,8,11,13-heptaene has a molecular weight of 191.23 g/mol, XLogP of 2.00, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 15-azatetracyclo[10.2.1.05,14.08,13]pentadeca-1(15),2,4,6,8,11,13-heptaene is sourced from PubChem (CID 54107119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).