11-methyl-3-(6-methylnaphthalen-2-yl)benzo[a]carbazole

C28H21N — CID 58410457

IUPAC11-methyl-3-(6-methylnaphthalen-2-yl)benzo[a]carbazole
SMILESCc1ccc2cc(-c3ccc4c(ccc5c6ccccc6n(C)c45)c3)ccc2c1
InChIInChI=1S/C28H21N/c1-18-7-8-20-16-21(10-9-19(20)15-18)22-11-13-24-23(17-22)12-14-26-25-5-3-4-6-27(25)29(2)28(24)26/h3-17H,1-2H3
InChIKeyMIWXBDPTJJXKFV-UHFFFAOYSA-N
MW371.48 g/mol
LogP7.61
Rot. Bonds1

About 11-methyl-3-(6-methylnaphthalen-2-yl)benzo[a]carbazole

11-methyl-3-(6-methylnaphthalen-2-yl)benzo[a]carbazole (PubChem CID 58410457) has the molecular formula C28H21N and a molecular weight of 371.48 g/mol. Its IUPAC name is 11-methyl-3-(6-methylnaphthalen-2-yl)benzo[a]carbazole.

Molecular Properties

Compound Name11-methyl-3-(6-methylnaphthalen-2-yl)benzo[a]carbazole
PubChem CID58410457
Molecular FormulaC28H21N
Molecular Weight371.48 g/mol
Exact Mass371.17
IUPAC Name11-methyl-3-(6-methylnaphthalen-2-yl)benzo[a]carbazole
SMILESCc1ccc2cc(-c3ccc4c(ccc5c6ccccc6n(C)c45)c3)ccc2c1
InChIInChI=1S/C28H21N/c1-18-7-8-20-16-21(10-9-19(20)15-18)22-11-13-24-23(17-22)12-14-26-25-5-3-4-6-27(25)29(2)28(24)26/h3-17H,1-2H3
InChIKeyMIWXBDPTJJXKFV-UHFFFAOYSA-N
XLogP7.61
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.48
LogP ≤ 57.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 11-methyl-3-(6-methylnaphthalen-2-yl)benzo[a]carbazole 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

7-methyl-10-(11-methylbenzo[a]carbazol-3-yl)benzo[c]carbazole
CID 134240713
12-methyl-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;12-methyl-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;11-methylbenzo[a]carbazole;5-methylbenzo[b]carbazole;9-methylcarbazole
CID 163692832
2-chloro-11-methylnaphtho[2,1-a]carbazole
CID 89117391
11-methyl-8-(4-phenylphenyl)benzo[a]carbazole;yttrium
CID 58410518
5,11-dimethylbenzo[a]carbazole
CID 58410472
16,20-dimethyl-20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1(25),2,4,6,8,10,12,14(19),15,17,21,23-dodecaene
CID 164939565
9-[4-[10-(6-methylnaphthalen-2-yl)anthracen-9-yl]phenyl]carbazole
CID 58876173
7,9-dimethyl-1-phenylcarbazole
CID 118392012
methane;2-methyl-6-phenylnaphthalene
CID 144703390
ethane;9-methyl-3-(9-methylcarbazol-3-yl)carbazole
CID 158738351
9-[3-[10-(6-methylnaphthalen-2-yl)anthracen-9-yl]phenyl]carbazole
CID 58875995
2-methyl-6-[3-(6-methylnaphthalen-2-yl)phenyl]naphthalene
CID 58943209

Frequently Asked Questions

What is the IUPAC name of 11-methyl-3-(6-methylnaphthalen-2-yl)benzo[a]carbazole?
The IUPAC name of 11-methyl-3-(6-methylnaphthalen-2-yl)benzo[a]carbazole (CID 58410457) is 11-methyl-3-(6-methylnaphthalen-2-yl)benzo[a]carbazole.
What is the SMILES notation for 11-methyl-3-(6-methylnaphthalen-2-yl)benzo[a]carbazole?
The canonical SMILES for 11-methyl-3-(6-methylnaphthalen-2-yl)benzo[a]carbazole is Cc1ccc2cc(-c3ccc4c(ccc5c6ccccc6n(C)c45)c3)ccc2c1.
What is the InChIKey of 11-methyl-3-(6-methylnaphthalen-2-yl)benzo[a]carbazole?
The InChIKey is MIWXBDPTJJXKFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H21N/c1-18-7-8-20-16-21(10-9-19(20)15-18)22-11-13-24-23(17-22)12-14-26-25-5-3-4-6-27(25)29(2)28(24)26/h3-17H,1-2H3.
What are the key properties of 11-methyl-3-(6-methylnaphthalen-2-yl)benzo[a]carbazole?
11-methyl-3-(6-methylnaphthalen-2-yl)benzo[a]carbazole has a molecular weight of 371.48 g/mol, XLogP of 7.61, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 11-methyl-3-(6-methylnaphthalen-2-yl)benzo[a]carbazole is sourced from PubChem (CID 58410457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).