1-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylbenzimidazole

C34H26N2 — CID 143828968

IUPAC1-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylbenzimidazole
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)cc21
InChIInChI=1S/C34H26N2/c1-34(2)29-13-7-6-12-27(29)28-21-18-25(22-30(28)34)23-16-19-26(20-17-23)36-32-15-9-8-14-31(32)35-33(36)24-10-4-3-5-11-24/h3-22H,1-2H3
InChIKeyFUIYBEVACUCDOS-UHFFFAOYSA-N
MW462.60 g/mol
LogP8.67
Rot. Bonds3

About 1-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylbenzimidazole

1-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylbenzimidazole (PubChem CID 143828968) has the molecular formula C34H26N2 and a molecular weight of 462.60 g/mol. Its IUPAC name is 1-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylbenzimidazole.

Molecular Properties

Compound Name1-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylbenzimidazole
PubChem CID143828968
Molecular FormulaC34H26N2
Molecular Weight462.60 g/mol
Exact Mass462.21
IUPAC Name1-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylbenzimidazole
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)cc21
InChIInChI=1S/C34H26N2/c1-34(2)29-13-7-6-12-27(29)28-21-18-25(22-30(28)34)23-16-19-26(20-17-23)36-32-15-9-8-14-31(32)35-33(36)24-10-4-3-5-11-24/h3-22H,1-2H3
InChIKeyFUIYBEVACUCDOS-UHFFFAOYSA-N
XLogP8.67
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500462.60
LogP ≤ 58.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-1-phenylbenzimidazole
CID 143828986
1-[4-(9,9-dimethyl-7-naphthalen-2-ylfluoren-2-yl)phenyl]-2-phenylbenzimidazole
CID 143828941
1-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-methylbenzimidazole
CID 143828980
2-(4-phenylphenyl)-1-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]benzimidazole
CID 170942090
2-[4-[14,21-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethyl-17-pentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaenyl]phenyl]-1-phenylbenzimidazole
CID 58411797
2-[4-[10,10-dimethyl-14,21-bis(4-phenylphenyl)-7-pentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,11,13,15,17,19-decaenyl]phenyl]-1-phenylbenzimidazole
CID 58411779
5-[4-[9,10-bis(9,9-dimethylfluoren-2-yl)anthracen-2-yl]phenyl]-1,2-diphenylbenzimidazole
CID 129192558
12,12-dimethyl-2,8-diphenyl-11-[4-(2-phenylbenzimidazol-1-yl)phenyl]indeno[2,1-a]carbazole
CID 90324800
ethene;1-[4-(7'-naphthalen-2-yl-9,9'-spirobi[fluorene]-2'-yl)phenyl]-2-phenylbenzimidazole
CID 143828948
2-[14,21-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethyl-7-pentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,11,13,15,17,19-decaenyl]-1-phenylbenzimidazole
CID 58411752
12,12-dimethyl-2,8-diphenyl-11-[4-(1-phenylbenzimidazol-2-yl)phenyl]indeno[2,1-a]carbazole
CID 90324779
9,9-dimethyl-10-phenyl-2-[4-(2-phenylbenzimidazol-1-yl)phenyl]acridine;ethane
CID 158720213

Frequently Asked Questions

What is the IUPAC name of 1-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylbenzimidazole?
The IUPAC name of 1-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylbenzimidazole (CID 143828968) is 1-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylbenzimidazole.
What is the SMILES notation for 1-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylbenzimidazole?
The canonical SMILES for 1-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylbenzimidazole is CC1(C)c2ccccc2-c2ccc(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)cc21.
What is the InChIKey of 1-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylbenzimidazole?
The InChIKey is FUIYBEVACUCDOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H26N2/c1-34(2)29-13-7-6-12-27(29)28-21-18-25(22-30(28)34)23-16-19-26(20-17-23)36-32-15-9-8-14-31(32)35-33(36)24-10-4-3-5-11-24/h3-22H,1-2H3.
What are the key properties of 1-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylbenzimidazole?
1-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylbenzimidazole has a molecular weight of 462.60 g/mol, XLogP of 8.67, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylbenzimidazole is sourced from PubChem (CID 143828968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).