10,10-dimethyl-5-(1-phenylbenzimidazol-4-yl)indeno[1,2-b]indole

C30H23N3 — CID 121285583

IUPAC10,10-dimethyl-5-(1-phenylbenzimidazol-4-yl)indeno[1,2-b]indole
SMILESCC1(C)c2ccccc2-c2c1c1ccccc1n2-c1cccc2c1ncn2-c1ccccc1
InChIInChI=1S/C30H23N3/c1-30(2)23-15-8-6-13-21(23)29-27(30)22-14-7-9-16-24(22)33(29)26-18-10-17-25-28(26)31-19-32(25)20-11-4-3-5-12-20/h3-19H,1-2H3
InChIKeyXPNXSFMHIINRKV-UHFFFAOYSA-N
MW425.54 g/mol
LogP7.28
Rot. Bonds2

About 10,10-dimethyl-5-(1-phenylbenzimidazol-4-yl)indeno[1,2-b]indole

10,10-dimethyl-5-(1-phenylbenzimidazol-4-yl)indeno[1,2-b]indole (PubChem CID 121285583) has the molecular formula C30H23N3 and a molecular weight of 425.54 g/mol. Its IUPAC name is 10,10-dimethyl-5-(1-phenylbenzimidazol-4-yl)indeno[1,2-b]indole.

Molecular Properties

Compound Name10,10-dimethyl-5-(1-phenylbenzimidazol-4-yl)indeno[1,2-b]indole
PubChem CID121285583
Molecular FormulaC30H23N3
Molecular Weight425.54 g/mol
Exact Mass425.19
IUPAC Name10,10-dimethyl-5-(1-phenylbenzimidazol-4-yl)indeno[1,2-b]indole
SMILESCC1(C)c2ccccc2-c2c1c1ccccc1n2-c1cccc2c1ncn2-c1ccccc1
InChIInChI=1S/C30H23N3/c1-30(2)23-15-8-6-13-21(23)29-27(30)22-14-7-9-16-24(22)33(29)26-18-10-17-25-28(26)31-19-32(25)20-11-4-3-5-12-20/h3-19H,1-2H3
InChIKeyXPNXSFMHIINRKV-UHFFFAOYSA-N
XLogP7.28
TPSA22.75 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500425.54
LogP ≤ 57.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

10,10-dimethyl-5-pyrimidin-2-ylindeno[1,2-b]indole
CID 121298587
10,10-dimethyl-5-(4-methylphenyl)indeno[1,2-b]indole
CID 144549130
12,12-dimethyl-22-(1-phenylbenzimidazol-4-yl)-22-azahexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene
CID 122464457
8-(10,10-dimethyl-5-phenylindeno[1,2-b]indol-8-yl)-10,10-dimethyl-5-phenylindeno[1,2-b]indole
CID 121275073
8-(4-carbazol-9-ylphenyl)-10,10-dimethyl-5-phenylindeno[1,2-b]indole
CID 121274991
10,10-dimethyl-5-(4-phenylquinazolin-2-yl)indeno[1,2-b]indole
CID 129194138
12,12-dimethyl-11-(1-phenylbenzimidazol-5-yl)indeno[2,1-a]carbazole
CID 118502264
2-(10,10-dimethylindeno[1,2-b]indol-5-yl)benzene-1,3-dicarbonitrile
CID 145009985
5-(3-chloro-5-methylphenyl)-10,10-dimethylindeno[1,2-b]indole
CID 164771283
3-[9-(9,9-dimethylfluoren-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(9,9-dimethylfluoren-1-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 163519733
10-(10,10-dimethyl-5-phenylindeno[1,2-b]indol-8-yl)phenothiazine
CID 121275039
1-bromo-10,10-dimethyl-5-phenylindeno[1,2-b]indole
CID 121302697

Frequently Asked Questions

What is the IUPAC name of 10,10-dimethyl-5-(1-phenylbenzimidazol-4-yl)indeno[1,2-b]indole?
The IUPAC name of 10,10-dimethyl-5-(1-phenylbenzimidazol-4-yl)indeno[1,2-b]indole (CID 121285583) is 10,10-dimethyl-5-(1-phenylbenzimidazol-4-yl)indeno[1,2-b]indole.
What is the SMILES notation for 10,10-dimethyl-5-(1-phenylbenzimidazol-4-yl)indeno[1,2-b]indole?
The canonical SMILES for 10,10-dimethyl-5-(1-phenylbenzimidazol-4-yl)indeno[1,2-b]indole is CC1(C)c2ccccc2-c2c1c1ccccc1n2-c1cccc2c1ncn2-c1ccccc1.
What is the InChIKey of 10,10-dimethyl-5-(1-phenylbenzimidazol-4-yl)indeno[1,2-b]indole?
The InChIKey is XPNXSFMHIINRKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H23N3/c1-30(2)23-15-8-6-13-21(23)29-27(30)22-14-7-9-16-24(22)33(29)26-18-10-17-25-28(26)31-19-32(25)20-11-4-3-5-12-20/h3-19H,1-2H3.
What are the key properties of 10,10-dimethyl-5-(1-phenylbenzimidazol-4-yl)indeno[1,2-b]indole?
10,10-dimethyl-5-(1-phenylbenzimidazol-4-yl)indeno[1,2-b]indole has a molecular weight of 425.54 g/mol, XLogP of 7.28, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10,10-dimethyl-5-(1-phenylbenzimidazol-4-yl)indeno[1,2-b]indole is sourced from PubChem (CID 121285583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).