9-(4-cyclohexa-1,5-dien-1-ylcyclohexa-1,5-dien-1-yl)carbazole

C24H21N — CID 145272973

IUPAC9-(4-cyclohexa-1,5-dien-1-ylcyclohexa-1,5-dien-1-yl)carbazole
SMILESC1=CC(C2C=CC(n3c4ccccc4c4ccccc43)=CC2)=CCC1
InChIInChI=1S/C24H21N/c1-2-8-18(9-3-1)19-14-16-20(17-15-19)25-23-12-6-4-10-21(23)22-11-5-7-13-24(22)25/h2,4-14,16-17,19H,1,3,15H2
InChIKeyOZTLSZDFQSSNDQ-UHFFFAOYSA-N
MW323.44 g/mol
LogP6.49
Rot. Bonds2

About 9-(4-cyclohexa-1,5-dien-1-ylcyclohexa-1,5-dien-1-yl)carbazole

9-(4-cyclohexa-1,5-dien-1-ylcyclohexa-1,5-dien-1-yl)carbazole (PubChem CID 145272973) has the molecular formula C24H21N and a molecular weight of 323.44 g/mol. Its IUPAC name is 9-(4-cyclohexa-1,5-dien-1-ylcyclohexa-1,5-dien-1-yl)carbazole.

Molecular Properties

Compound Name9-(4-cyclohexa-1,5-dien-1-ylcyclohexa-1,5-dien-1-yl)carbazole
PubChem CID145272973
Molecular FormulaC24H21N
Molecular Weight323.44 g/mol
Exact Mass323.17
IUPAC Name9-(4-cyclohexa-1,5-dien-1-ylcyclohexa-1,5-dien-1-yl)carbazole
SMILESC1=CC(C2C=CC(n3c4ccccc4c4ccccc43)=CC2)=CCC1
InChIInChI=1S/C24H21N/c1-2-8-18(9-3-1)19-14-16-20(17-15-19)25-23-12-6-4-10-21(23)22-11-5-7-13-24(22)25/h2,4-14,16-17,19H,1,3,15H2
InChIKeyOZTLSZDFQSSNDQ-UHFFFAOYSA-N
XLogP6.49
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500323.44
LogP ≤ 56.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-[4-(4-carbazol-9-ylcyclohexa-2,4-dien-1-yl)phenyl]carbazole
CID 129310423
9-(4-phenylcyclohexa-1,5-dien-1-yl)-3-(4-phenylphenyl)carbazole
CID 129022406
9-(4-ethylcyclohexa-1,5-dien-1-yl)carbazole
CID 123432152
3-(9-cyclohexa-1,5-dien-1-ylcarbazol-3-yl)-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole
CID 149407778
9-cyclohexa-1,5-dien-1-yl-3,6-bis(9-phenylcarbazol-3-yl)carbazole
CID 155112233
9-cyclohexa-1,5-dien-1-yl-2-(10-phenanthren-2-ylanthracen-9-yl)carbazole
CID 89189458
9-cyclohexa-1,5-dien-1-yl-N-(4-cyclohexa-1,5-dien-1-ylcyclohexa-1,5-dien-1-yl)-N-[4-[4-[N-(4-cyclohexa-2,4-dien-1-ylcyclohex-2-en-1-yl)-4-(2-methylcyclohex-3-en-1-yl)anilino]cyclohexa-2,4-dien-1-yl]cyclohexa-1,5-dien-1-yl]carbazol-2-amine
CID 175611212
3-(9-cyclohexa-1,5-dien-1-ylcarbazol-3-yl)-6-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 123699580
4-tert-butyl-9-cyclohexa-1,5-dien-1-ylcarbazole
CID 170102498
9-(3-carbazol-9-yl-6-methylcyclohexa-1,3-dien-1-yl)carbazole
CID 143793752
9-cyclohexa-1,5-dien-1-yl-3-(9-dibenzothiophen-4-yl-3,4-dihydrocarbazol-3-yl)carbazole
CID 166889623
19-cyclohexa-1,5-dien-1-yl-11-oxa-15,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaen-15-amine
CID 163740808

Frequently Asked Questions

What is the IUPAC name of 9-(4-cyclohexa-1,5-dien-1-ylcyclohexa-1,5-dien-1-yl)carbazole?
The IUPAC name of 9-(4-cyclohexa-1,5-dien-1-ylcyclohexa-1,5-dien-1-yl)carbazole (CID 145272973) is 9-(4-cyclohexa-1,5-dien-1-ylcyclohexa-1,5-dien-1-yl)carbazole.
What is the SMILES notation for 9-(4-cyclohexa-1,5-dien-1-ylcyclohexa-1,5-dien-1-yl)carbazole?
The canonical SMILES for 9-(4-cyclohexa-1,5-dien-1-ylcyclohexa-1,5-dien-1-yl)carbazole is C1=CC(C2C=CC(n3c4ccccc4c4ccccc43)=CC2)=CCC1.
What is the InChIKey of 9-(4-cyclohexa-1,5-dien-1-ylcyclohexa-1,5-dien-1-yl)carbazole?
The InChIKey is OZTLSZDFQSSNDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N/c1-2-8-18(9-3-1)19-14-16-20(17-15-19)25-23-12-6-4-10-21(23)22-11-5-7-13-24(22)25/h2,4-14,16-17,19H,1,3,15H2.
What are the key properties of 9-(4-cyclohexa-1,5-dien-1-ylcyclohexa-1,5-dien-1-yl)carbazole?
9-(4-cyclohexa-1,5-dien-1-ylcyclohexa-1,5-dien-1-yl)carbazole has a molecular weight of 323.44 g/mol, XLogP of 6.49, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-cyclohexa-1,5-dien-1-ylcyclohexa-1,5-dien-1-yl)carbazole is sourced from PubChem (CID 145272973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).