1-(7-azatricyclo[6.3.1.04,12]dodeca-1(12),2,4,6,8,10-hexaen-6-yl)-9-methylcarbazole

C24H16N2 — CID 59621434

IUPAC1-(7-azatricyclo[6.3.1.04,12]dodeca-1(12),2,4,6,8,10-hexaen-6-yl)-9-methylcarbazole
SMILESCn1c2ccccc2c2cccc(-c3cc4c5c(cccc5n3)C=C4)c21
InChIInChI=1S/C24H16N2/c1-26-22-11-3-2-7-17(22)18-8-5-9-19(24(18)26)21-14-16-13-12-15-6-4-10-20(25-21)23(15)16/h2-14H,1H3
InChIKeyWQNWOCJWSZXCTN-UHFFFAOYSA-N
MW332.41 g/mol
LogP6.03
Rot. Bonds1

About 1-(7-azatricyclo[6.3.1.04,12]dodeca-1(12),2,4,6,8,10-hexaen-6-yl)-9-methylcarbazole

1-(7-azatricyclo[6.3.1.04,12]dodeca-1(12),2,4,6,8,10-hexaen-6-yl)-9-methylcarbazole (PubChem CID 59621434) has the molecular formula C24H16N2 and a molecular weight of 332.41 g/mol. Its IUPAC name is 1-(7-azatricyclo[6.3.1.04,12]dodeca-1(12),2,4,6,8,10-hexaen-6-yl)-9-methylcarbazole.

Molecular Properties

Compound Name1-(7-azatricyclo[6.3.1.04,12]dodeca-1(12),2,4,6,8,10-hexaen-6-yl)-9-methylcarbazole
PubChem CID59621434
Molecular FormulaC24H16N2
Molecular Weight332.41 g/mol
Exact Mass332.13
IUPAC Name1-(7-azatricyclo[6.3.1.04,12]dodeca-1(12),2,4,6,8,10-hexaen-6-yl)-9-methylcarbazole
SMILESCn1c2ccccc2c2cccc(-c3cc4c5c(cccc5n3)C=C4)c21
InChIInChI=1S/C24H16N2/c1-26-22-11-3-2-7-17(22)18-8-5-9-19(24(18)26)21-14-16-13-12-15-6-4-10-20(25-21)23(15)16/h2-14H,1H3
InChIKeyWQNWOCJWSZXCTN-UHFFFAOYSA-N
XLogP6.03
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.41
LogP ≤ 56.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(7-azatricyclo[6.3.1.04,12]dodeca-1(12),2,4,6,8,10-hexaen-6-yl)-9-methylcarbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9-methyl-1-quinolin-2-ylcarbazole
CID 140671194
4-(9-methylcarbazol-1-yl)-N,N-bis[4-(9-methylcarbazol-1-yl)phenyl]aniline
CID 146558759
4-(7-azatricyclo[6.3.1.04,12]dodeca-1(12),2,4,6,8,10-hexaen-6-yl)-9-methyl-3H-carbazol-3-ide;4-hydroxypent-3-en-2-one;iridium
CID 159898463
11-methyl-5-pyridin-2-ylbenzo[a]carbazole
CID 58410525
5,11-dimethylbenzo[a]carbazole
CID 58410472
iridium;6-[3-(2-methylphenyl)benzene-6-id-1-yl]-7-azatricyclo[6.3.1.04,12]dodeca-1(12),2,4,6,8,10-hexaene
CID 59621999
3,23-dimethyl-3,14,21,23-tetrazahexacyclo[11.10.0.02,10.04,9.014,22.015,20]tricosa-1(13),2(10),4,6,8,11,15,17,19,21-decaene
CID 155082006
3-(9-methylcarbazol-1-yl)dibenzothiophene 5,5-dioxide
CID 126632614
5,11-dimethyl-6,12-dinaphthalen-1-ylindolo[3,2-b]carbazole
CID 163788031
1-[4-carbazol-9-yl-6-(9-phenylcarbazol-1-yl)-2-pyridinyl]-9-phenylcarbazole
CID 71127177
1-fluoro-9-methylcarbazole
CID 139447921
6-[3-(4-fluorophenyl)phenyl]-7-azatricyclo[6.3.1.04,12]dodeca-1(12),2,4,6,8,10-hexaene
CID 59622043

Frequently Asked Questions

What is the IUPAC name of 1-(7-azatricyclo[6.3.1.04,12]dodeca-1(12),2,4,6,8,10-hexaen-6-yl)-9-methylcarbazole?
The IUPAC name of 1-(7-azatricyclo[6.3.1.04,12]dodeca-1(12),2,4,6,8,10-hexaen-6-yl)-9-methylcarbazole (CID 59621434) is 1-(7-azatricyclo[6.3.1.04,12]dodeca-1(12),2,4,6,8,10-hexaen-6-yl)-9-methylcarbazole.
What is the SMILES notation for 1-(7-azatricyclo[6.3.1.04,12]dodeca-1(12),2,4,6,8,10-hexaen-6-yl)-9-methylcarbazole?
The canonical SMILES for 1-(7-azatricyclo[6.3.1.04,12]dodeca-1(12),2,4,6,8,10-hexaen-6-yl)-9-methylcarbazole is Cn1c2ccccc2c2cccc(-c3cc4c5c(cccc5n3)C=C4)c21.
What is the InChIKey of 1-(7-azatricyclo[6.3.1.04,12]dodeca-1(12),2,4,6,8,10-hexaen-6-yl)-9-methylcarbazole?
The InChIKey is WQNWOCJWSZXCTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16N2/c1-26-22-11-3-2-7-17(22)18-8-5-9-19(24(18)26)21-14-16-13-12-15-6-4-10-20(25-21)23(15)16/h2-14H,1H3.
What are the key properties of 1-(7-azatricyclo[6.3.1.04,12]dodeca-1(12),2,4,6,8,10-hexaen-6-yl)-9-methylcarbazole?
1-(7-azatricyclo[6.3.1.04,12]dodeca-1(12),2,4,6,8,10-hexaen-6-yl)-9-methylcarbazole has a molecular weight of 332.41 g/mol, XLogP of 6.03, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-azatricyclo[6.3.1.04,12]dodeca-1(12),2,4,6,8,10-hexaen-6-yl)-9-methylcarbazole is sourced from PubChem (CID 59621434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).