13,15-dimethyl-13,15-diazatetracyclo[8.6.0.02,7.011,16]hexadeca-2,4,6,8,11(16)-pentaene-12,14-dione

C16H14N2O2 — CID 12034984

IUPAC13,15-dimethyl-13,15-diazatetracyclo[8.6.0.02,7.011,16]hexadeca-2,4,6,8,11(16)-pentaene-12,14-dione
SMILESCn1c2c(c(=O)n(C)c1=O)C1C=Cc3ccccc3C21
InChIInChI=1S/C16H14N2O2/c1-17-14-12-10-6-4-3-5-9(10)7-8-11(12)13(14)15(19)18(2)16(17)20/h3-8,11-12H,1-2H3
InChIKeyUAGMGBKUFUHZNQ-UHFFFAOYSA-N
MW266.30 g/mol
LogP1.34
Rot. Bonds

About 13,15-dimethyl-13,15-diazatetracyclo[8.6.0.02,7.011,16]hexadeca-2,4,6,8,11(16)-pentaene-12,14-dione

13,15-dimethyl-13,15-diazatetracyclo[8.6.0.02,7.011,16]hexadeca-2,4,6,8,11(16)-pentaene-12,14-dione (PubChem CID 12034984) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is 13,15-dimethyl-13,15-diazatetracyclo[8.6.0.02,7.011,16]hexadeca-2,4,6,8,11(16)-pentaene-12,14-dione.

Molecular Properties

Compound Name13,15-dimethyl-13,15-diazatetracyclo[8.6.0.02,7.011,16]hexadeca-2,4,6,8,11(16)-pentaene-12,14-dione
PubChem CID12034984
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC Name13,15-dimethyl-13,15-diazatetracyclo[8.6.0.02,7.011,16]hexadeca-2,4,6,8,11(16)-pentaene-12,14-dione
SMILESCn1c2c(c(=O)n(C)c1=O)C1C=Cc3ccccc3C21
InChIInChI=1S/C16H14N2O2/c1-17-14-12-10-6-4-3-5-9(10)7-8-11(12)13(14)15(19)18(2)16(17)20/h3-8,11-12H,1-2H3
InChIKeyUAGMGBKUFUHZNQ-UHFFFAOYSA-N
XLogP1.34
TPSA44.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 13,15-dimethyl-13,15-diazatetracyclo[8.6.0.02,7.011,16]hexadeca-2,4,6,8,11(16)-pentaene-12,14-dione with MolForge

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Frequently Asked Questions

What is the IUPAC name of 13,15-dimethyl-13,15-diazatetracyclo[8.6.0.02,7.011,16]hexadeca-2,4,6,8,11(16)-pentaene-12,14-dione?
The IUPAC name of 13,15-dimethyl-13,15-diazatetracyclo[8.6.0.02,7.011,16]hexadeca-2,4,6,8,11(16)-pentaene-12,14-dione (CID 12034984) is 13,15-dimethyl-13,15-diazatetracyclo[8.6.0.02,7.011,16]hexadeca-2,4,6,8,11(16)-pentaene-12,14-dione.
What is the SMILES notation for 13,15-dimethyl-13,15-diazatetracyclo[8.6.0.02,7.011,16]hexadeca-2,4,6,8,11(16)-pentaene-12,14-dione?
The canonical SMILES for 13,15-dimethyl-13,15-diazatetracyclo[8.6.0.02,7.011,16]hexadeca-2,4,6,8,11(16)-pentaene-12,14-dione is Cn1c2c(c(=O)n(C)c1=O)C1C=Cc3ccccc3C21.
What is the InChIKey of 13,15-dimethyl-13,15-diazatetracyclo[8.6.0.02,7.011,16]hexadeca-2,4,6,8,11(16)-pentaene-12,14-dione?
The InChIKey is UAGMGBKUFUHZNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c1-17-14-12-10-6-4-3-5-9(10)7-8-11(12)13(14)15(19)18(2)16(17)20/h3-8,11-12H,1-2H3.
What are the key properties of 13,15-dimethyl-13,15-diazatetracyclo[8.6.0.02,7.011,16]hexadeca-2,4,6,8,11(16)-pentaene-12,14-dione?
13,15-dimethyl-13,15-diazatetracyclo[8.6.0.02,7.011,16]hexadeca-2,4,6,8,11(16)-pentaene-12,14-dione has a molecular weight of 266.30 g/mol, XLogP of 1.34, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 13,15-dimethyl-13,15-diazatetracyclo[8.6.0.02,7.011,16]hexadeca-2,4,6,8,11(16)-pentaene-12,14-dione is sourced from PubChem (CID 12034984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).