12-(4-methylphenyl)-7H-indeno[1,2-a]carbazole

C26H19N — CID 159826504

IUPAC12-(4-methylphenyl)-7H-indeno[1,2-a]carbazole
SMILESCc1ccc(-n2c3ccccc3c3ccc4c(c32)-c2ccccc2C4)cc1
InChIInChI=1S/C26H19N/c1-17-10-13-20(14-11-17)27-24-9-5-4-8-22(24)23-15-12-19-16-18-6-2-3-7-21(18)25(19)26(23)27/h2-15H,16H2,1H3
InChIKeyCREJYYTXSHDPEQ-UHFFFAOYSA-N
MW345.45 g/mol
LogP6.66
Rot. Bonds1

About 12-(4-methylphenyl)-7H-indeno[1,2-a]carbazole

12-(4-methylphenyl)-7H-indeno[1,2-a]carbazole (PubChem CID 159826504) has the molecular formula C26H19N and a molecular weight of 345.45 g/mol. Its IUPAC name is 12-(4-methylphenyl)-7H-indeno[1,2-a]carbazole.

Molecular Properties

Compound Name12-(4-methylphenyl)-7H-indeno[1,2-a]carbazole
PubChem CID159826504
Molecular FormulaC26H19N
Molecular Weight345.45 g/mol
Exact Mass345.15
IUPAC Name12-(4-methylphenyl)-7H-indeno[1,2-a]carbazole
SMILESCc1ccc(-n2c3ccccc3c3ccc4c(c32)-c2ccccc2C4)cc1
InChIInChI=1S/C26H19N/c1-17-10-13-20(14-11-17)27-24-9-5-4-8-22(24)23-15-12-19-16-18-6-2-3-7-21(18)25(19)26(23)27/h2-15H,16H2,1H3
InChIKeyCREJYYTXSHDPEQ-UHFFFAOYSA-N
XLogP6.66
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500345.45
LogP ≤ 56.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

12-[4-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-7H-indeno[1,2-a]carbazole
CID 169058434
12-propan-2-yl-7H-indeno[1,2-a]carbazole
CID 129063021
14-azaheptacyclo[12.10.1.13,24.02,7.08,13.015,20.021,25]hexacosa-1(24),2,4,6,8,10,12,15,17,19,21(25),22-dodecaene
CID 162093408
9-(9H-fluoren-3-yl)-14-(4-methylphenyl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 163468224
24-azahexacyclo[11.11.0.02,10.03,8.014,19.020,24]tetracosa-1(13),2(10),3,5,7,11,14,16,18,20,22-undecaene
CID 158281474
12-naphthalen-2-yl-3-(9-phenylcarbazol-3-yl)-[1]benzothiolo[2,3-a]carbazole;5-naphthalen-2-yl-2-(9-phenylcarbazol-3-yl)-[1]benzothiolo[3,2-c]carbazole;12-naphthalen-2-yl-3-(9-phenylcarbazol-3-yl)-7H-indeno[1,2-a]carbazole
CID 158070400
3-(9H-fluoren-4-yl)-6-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 130230877
5-(9H-fluoren-2-yl)-12-phenylindolo[3,2-c]carbazole
CID 130417397
5-(9H-fluoren-3-yl)-12-phenylindolo[3,2-c]carbazole
CID 121289125
9-phenyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 122434437
3-[9-[2-(9H-fluoren-4-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 126753267
7-(4-methylphenyl)-5-[4-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]indolo[2,3-b]carbazole
CID 118504699

Frequently Asked Questions

What is the IUPAC name of 12-(4-methylphenyl)-7H-indeno[1,2-a]carbazole?
The IUPAC name of 12-(4-methylphenyl)-7H-indeno[1,2-a]carbazole (CID 159826504) is 12-(4-methylphenyl)-7H-indeno[1,2-a]carbazole.
What is the SMILES notation for 12-(4-methylphenyl)-7H-indeno[1,2-a]carbazole?
The canonical SMILES for 12-(4-methylphenyl)-7H-indeno[1,2-a]carbazole is Cc1ccc(-n2c3ccccc3c3ccc4c(c32)-c2ccccc2C4)cc1.
What is the InChIKey of 12-(4-methylphenyl)-7H-indeno[1,2-a]carbazole?
The InChIKey is CREJYYTXSHDPEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H19N/c1-17-10-13-20(14-11-17)27-24-9-5-4-8-22(24)23-15-12-19-16-18-6-2-3-7-21(18)25(19)26(23)27/h2-15H,16H2,1H3.
What are the key properties of 12-(4-methylphenyl)-7H-indeno[1,2-a]carbazole?
12-(4-methylphenyl)-7H-indeno[1,2-a]carbazole has a molecular weight of 345.45 g/mol, XLogP of 6.66, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 12-(4-methylphenyl)-7H-indeno[1,2-a]carbazole is sourced from PubChem (CID 159826504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).