7,7-dimethyl-5-(8-methylnaphthalen-1-yl)indeno[2,1-b]carbazole

C32H25N — CID 155130310

IUPAC7,7-dimethyl-5-(8-methylnaphthalen-1-yl)indeno[2,1-b]carbazole
SMILESCc1cccc2cccc(-n3c4ccccc4c4cc5c(cc43)C(C)(C)c3ccccc3-5)c12
InChIInChI=1S/C32H25N/c1-20-10-8-11-21-12-9-17-29(31(20)21)33-28-16-7-5-14-23(28)25-18-24-22-13-4-6-15-26(22)32(2,3)27(24)19-30(25)33/h4-19H,1-3H3
InChIKeyATSBPBFUDVJCDC-UHFFFAOYSA-N
MW423.56 g/mol
LogP8.55
Rot. Bonds1

About 7,7-dimethyl-5-(8-methylnaphthalen-1-yl)indeno[2,1-b]carbazole

7,7-dimethyl-5-(8-methylnaphthalen-1-yl)indeno[2,1-b]carbazole (PubChem CID 155130310) has the molecular formula C32H25N and a molecular weight of 423.56 g/mol. Its IUPAC name is 7,7-dimethyl-5-(8-methylnaphthalen-1-yl)indeno[2,1-b]carbazole.

Molecular Properties

Compound Name7,7-dimethyl-5-(8-methylnaphthalen-1-yl)indeno[2,1-b]carbazole
PubChem CID155130310
Molecular FormulaC32H25N
Molecular Weight423.56 g/mol
Exact Mass423.20
IUPAC Name7,7-dimethyl-5-(8-methylnaphthalen-1-yl)indeno[2,1-b]carbazole
SMILESCc1cccc2cccc(-n3c4ccccc4c4cc5c(cc43)C(C)(C)c3ccccc3-5)c12
InChIInChI=1S/C32H25N/c1-20-10-8-11-21-12-9-17-29(31(20)21)33-28-16-7-5-14-23(28)25-18-24-22-13-4-6-15-26(22)32(2,3)27(24)19-30(25)33/h4-19H,1-3H3
InChIKeyATSBPBFUDVJCDC-UHFFFAOYSA-N
XLogP8.55
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500423.56
LogP ≤ 58.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

15,15-dimethyl-11,19-bis(9,9'-spirobi[fluorene]-4-yl)-11,19-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-dodecaene
CID 170015359
2-carbazol-9-yl-5-(11,11,19,19-tetramethyl-15-azaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(27),2,4(12),5,7,9,13,16,18(26),20,22,24-dodecaen-15-yl)benzene-1,4-dicarbonitrile
CID 121328841
11,11-dimethyl-5-(9-naphthalen-2-ylcarbazol-4-yl)indeno[1,2-b]carbazole
CID 118502163
2-[2-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]isoindole-1,3-dione
CID 158538200
11,11-dimethyl-5-phenanthren-9-ylindeno[1,2-b]carbazole
CID 118488779
5-(4-fluoranthen-8-ylphenyl)-7,7-dimethylindeno[2,1-b]carbazole
CID 118580618
5-[3-[3-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)phenyl]phenyl]-7,7-dimethylindeno[2,1-b]carbazole
CID 66805252
7,7-dimethyl-5-[9-(3-phenylphenyl)carbazol-1-yl]indeno[2,1-b]carbazole
CID 89472229
5-[6-(2-carbazol-9-ylcarbazol-9-yl)dibenzothiophen-4-yl]-7,7-dimethylindeno[2,1-b]carbazole
CID 118335098
7,7-dimethyl-2-(9-naphthalen-1-ylcarbazol-3-yl)-5-(4-phenylphenyl)indeno[2,1-b]carbazole;11,11-dimethyl-2-(9-naphthalen-1-ylcarbazol-3-yl)-5-(4-phenylphenyl)indeno[1,2-b]carbazole
CID 160620508
15-[4-(11,11-dimethyl-25-phenyl-15,25-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.019,24]heptacosa-1(16),2,4(12),5,7,9,13,17,19,21,23,26-dodecaen-15-yl)phenyl]-11,11-dimethyl-25-phenyl-15,25-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.019,24]heptacosa-1(16),2,4(12),5,7,9,13,17,19,21,23,26-dodecaene
CID 89492388
5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-(4-naphthalen-1-ylphenyl)phenyl]-7,7-dimethylindeno[2,1-b]carbazole
CID 126592268

Frequently Asked Questions

What is the IUPAC name of 7,7-dimethyl-5-(8-methylnaphthalen-1-yl)indeno[2,1-b]carbazole?
The IUPAC name of 7,7-dimethyl-5-(8-methylnaphthalen-1-yl)indeno[2,1-b]carbazole (CID 155130310) is 7,7-dimethyl-5-(8-methylnaphthalen-1-yl)indeno[2,1-b]carbazole.
What is the SMILES notation for 7,7-dimethyl-5-(8-methylnaphthalen-1-yl)indeno[2,1-b]carbazole?
The canonical SMILES for 7,7-dimethyl-5-(8-methylnaphthalen-1-yl)indeno[2,1-b]carbazole is Cc1cccc2cccc(-n3c4ccccc4c4cc5c(cc43)C(C)(C)c3ccccc3-5)c12.
What is the InChIKey of 7,7-dimethyl-5-(8-methylnaphthalen-1-yl)indeno[2,1-b]carbazole?
The InChIKey is ATSBPBFUDVJCDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H25N/c1-20-10-8-11-21-12-9-17-29(31(20)21)33-28-16-7-5-14-23(28)25-18-24-22-13-4-6-15-26(22)32(2,3)27(24)19-30(25)33/h4-19H,1-3H3.
What are the key properties of 7,7-dimethyl-5-(8-methylnaphthalen-1-yl)indeno[2,1-b]carbazole?
7,7-dimethyl-5-(8-methylnaphthalen-1-yl)indeno[2,1-b]carbazole has a molecular weight of 423.56 g/mol, XLogP of 8.55, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7-dimethyl-5-(8-methylnaphthalen-1-yl)indeno[2,1-b]carbazole is sourced from PubChem (CID 155130310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).