11-(2,6-dimethylphenyl)-2,4,6-trimethyl-6,9-diazatetracyclo[8.4.0.02,4.05,9]tetradeca-1(14),7,10,12-tetraene

C23H26N2 — CID 174345978

IUPAC11-(2,6-dimethylphenyl)-2,4,6-trimethyl-6,9-diazatetracyclo[8.4.0.02,4.05,9]tetradeca-1(14),7,10,12-tetraene
SMILESCc1cccc(C)c1-c1cccc2c1N1C=CN(C)C1C1(C)CC21C
InChIInChI=1S/C23H26N2/c1-15-8-6-9-16(2)19(15)17-10-7-11-18-20(17)25-13-12-24(5)21(25)23(4)14-22(18,23)3/h6-13,21H,14H2,1-5H3
InChIKeyUSIXOROQTBYDSS-UHFFFAOYSA-N
MW330.48 g/mol
LogP5.20
Rot. Bonds1

About 11-(2,6-dimethylphenyl)-2,4,6-trimethyl-6,9-diazatetracyclo[8.4.0.02,4.05,9]tetradeca-1(14),7,10,12-tetraene

11-(2,6-dimethylphenyl)-2,4,6-trimethyl-6,9-diazatetracyclo[8.4.0.02,4.05,9]tetradeca-1(14),7,10,12-tetraene (PubChem CID 174345978) has the molecular formula C23H26N2 and a molecular weight of 330.48 g/mol. Its IUPAC name is 11-(2,6-dimethylphenyl)-2,4,6-trimethyl-6,9-diazatetracyclo[8.4.0.02,4.05,9]tetradeca-1(14),7,10,12-tetraene.

Molecular Properties

Compound Name11-(2,6-dimethylphenyl)-2,4,6-trimethyl-6,9-diazatetracyclo[8.4.0.02,4.05,9]tetradeca-1(14),7,10,12-tetraene
PubChem CID174345978
Molecular FormulaC23H26N2
Molecular Weight330.48 g/mol
Exact Mass330.21
IUPAC Name11-(2,6-dimethylphenyl)-2,4,6-trimethyl-6,9-diazatetracyclo[8.4.0.02,4.05,9]tetradeca-1(14),7,10,12-tetraene
SMILESCc1cccc(C)c1-c1cccc2c1N1C=CN(C)C1C1(C)CC21C
InChIInChI=1S/C23H26N2/c1-15-8-6-9-16(2)19(15)17-10-7-11-18-20(17)25-13-12-24(5)21(25)23(4)14-22(18,23)3/h6-13,21H,14H2,1-5H3
InChIKeyUSIXOROQTBYDSS-UHFFFAOYSA-N
XLogP5.20
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.48
LogP ≤ 55.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 11-(2,6-dimethylphenyl)-2,4,6-trimethyl-6,9-diazatetracyclo[8.4.0.02,4.05,9]tetradeca-1(14),7,10,12-tetraene with MolForge

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Related Compounds

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CID 123333403
2,4,16,18-tetramethyl-4,7,13,16-tetrazahexacyclo[10.6.1.02,18.03,7.08,19.013,17]nonadeca-5,8(19),9,11,14-pentaene
CID 130458154
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CID 22075461
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9-ethyl-4,9-dimethylfluorene
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Frequently Asked Questions

What is the IUPAC name of 11-(2,6-dimethylphenyl)-2,4,6-trimethyl-6,9-diazatetracyclo[8.4.0.02,4.05,9]tetradeca-1(14),7,10,12-tetraene?
The IUPAC name of 11-(2,6-dimethylphenyl)-2,4,6-trimethyl-6,9-diazatetracyclo[8.4.0.02,4.05,9]tetradeca-1(14),7,10,12-tetraene (CID 174345978) is 11-(2,6-dimethylphenyl)-2,4,6-trimethyl-6,9-diazatetracyclo[8.4.0.02,4.05,9]tetradeca-1(14),7,10,12-tetraene.
What is the SMILES notation for 11-(2,6-dimethylphenyl)-2,4,6-trimethyl-6,9-diazatetracyclo[8.4.0.02,4.05,9]tetradeca-1(14),7,10,12-tetraene?
The canonical SMILES for 11-(2,6-dimethylphenyl)-2,4,6-trimethyl-6,9-diazatetracyclo[8.4.0.02,4.05,9]tetradeca-1(14),7,10,12-tetraene is Cc1cccc(C)c1-c1cccc2c1N1C=CN(C)C1C1(C)CC21C.
What is the InChIKey of 11-(2,6-dimethylphenyl)-2,4,6-trimethyl-6,9-diazatetracyclo[8.4.0.02,4.05,9]tetradeca-1(14),7,10,12-tetraene?
The InChIKey is USIXOROQTBYDSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2/c1-15-8-6-9-16(2)19(15)17-10-7-11-18-20(17)25-13-12-24(5)21(25)23(4)14-22(18,23)3/h6-13,21H,14H2,1-5H3.
What are the key properties of 11-(2,6-dimethylphenyl)-2,4,6-trimethyl-6,9-diazatetracyclo[8.4.0.02,4.05,9]tetradeca-1(14),7,10,12-tetraene?
11-(2,6-dimethylphenyl)-2,4,6-trimethyl-6,9-diazatetracyclo[8.4.0.02,4.05,9]tetradeca-1(14),7,10,12-tetraene has a molecular weight of 330.48 g/mol, XLogP of 5.20, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-(2,6-dimethylphenyl)-2,4,6-trimethyl-6,9-diazatetracyclo[8.4.0.02,4.05,9]tetradeca-1(14),7,10,12-tetraene is sourced from PubChem (CID 174345978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).