8-(4-phenylphenyl)-7,9-diazatricyclo[4.3.0.07,9]nona-1,3,5-triene

C19H14N2 — CID 118895588

IUPAC8-(4-phenylphenyl)-7,9-diazatricyclo[4.3.0.07,9]nona-1,3,5-triene
SMILESc1ccc(-c2ccc(C3n4c5ccccc5n43)cc2)cc1
InChIInChI=1S/C19H14N2/c1-2-6-14(7-3-1)15-10-12-16(13-11-15)19-20-17-8-4-5-9-18(17)21(19)20/h1-13,19H
InChIKeyMQZBTIACJDIKKB-UHFFFAOYSA-N
MW270.33 g/mol
LogP4.52
Rot. Bonds2

About 8-(4-phenylphenyl)-7,9-diazatricyclo[4.3.0.07,9]nona-1,3,5-triene

8-(4-phenylphenyl)-7,9-diazatricyclo[4.3.0.07,9]nona-1,3,5-triene (PubChem CID 118895588) has the molecular formula C19H14N2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 8-(4-phenylphenyl)-7,9-diazatricyclo[4.3.0.07,9]nona-1,3,5-triene.

Molecular Properties

Compound Name8-(4-phenylphenyl)-7,9-diazatricyclo[4.3.0.07,9]nona-1,3,5-triene
PubChem CID118895588
Molecular FormulaC19H14N2
Molecular Weight270.33 g/mol
Exact Mass270.12
IUPAC Name8-(4-phenylphenyl)-7,9-diazatricyclo[4.3.0.07,9]nona-1,3,5-triene
SMILESc1ccc(-c2ccc(C3n4c5ccccc5n43)cc2)cc1
InChIInChI=1S/C19H14N2/c1-2-6-14(7-3-1)15-10-12-16(13-11-15)19-20-17-8-4-5-9-18(17)21(19)20/h1-13,19H
InChIKeyMQZBTIACJDIKKB-UHFFFAOYSA-N
XLogP4.52
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,4-diphenylbenzene;1-phenyl-4-(4-phenylphenyl)benzene
CID 162098364
(2R,3R)-2,3-bis(4-phenylphenyl)oxirane
CID 15400082
azulene;phosphane
CID 175448344
benzene;tris(1,1'-biphenyl)
CID 162155747
1,3-diphenyl-2-(4-phenylphenyl)-2H-quinazolin-4-one
CID 11719397
1,4-bis[4-[4-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]benzene;ethane;1-phenyl-4-[4-[4-[4-[4-[4-[4-[4-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene
CID 162041275
1,1'-biphenyl;hydroiodide
CID 66586334
benzene;bis(1,1'-biphenyl);methane
CID 158742993
1,1'-biphenyl;indigane
CID 174363765
1,1'-biphenyl;mercury
CID 67099988
1,1'-biphenyl;hydrofluoride
CID 67516975
bis(1,1'-biphenyl);sulfane
CID 22247507

Frequently Asked Questions

What is the IUPAC name of 8-(4-phenylphenyl)-7,9-diazatricyclo[4.3.0.07,9]nona-1,3,5-triene?
The IUPAC name of 8-(4-phenylphenyl)-7,9-diazatricyclo[4.3.0.07,9]nona-1,3,5-triene (CID 118895588) is 8-(4-phenylphenyl)-7,9-diazatricyclo[4.3.0.07,9]nona-1,3,5-triene.
What is the SMILES notation for 8-(4-phenylphenyl)-7,9-diazatricyclo[4.3.0.07,9]nona-1,3,5-triene?
The canonical SMILES for 8-(4-phenylphenyl)-7,9-diazatricyclo[4.3.0.07,9]nona-1,3,5-triene is c1ccc(-c2ccc(C3n4c5ccccc5n43)cc2)cc1.
What is the InChIKey of 8-(4-phenylphenyl)-7,9-diazatricyclo[4.3.0.07,9]nona-1,3,5-triene?
The InChIKey is MQZBTIACJDIKKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2/c1-2-6-14(7-3-1)15-10-12-16(13-11-15)19-20-17-8-4-5-9-18(17)21(19)20/h1-13,19H.
What are the key properties of 8-(4-phenylphenyl)-7,9-diazatricyclo[4.3.0.07,9]nona-1,3,5-triene?
8-(4-phenylphenyl)-7,9-diazatricyclo[4.3.0.07,9]nona-1,3,5-triene has a molecular weight of 270.33 g/mol, XLogP of 4.52, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(4-phenylphenyl)-7,9-diazatricyclo[4.3.0.07,9]nona-1,3,5-triene is sourced from PubChem (CID 118895588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).