6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N,4,11-hexakis-phenylindeno[1,2-b]fluorene-2,8-diamine

C60H48N2 — CID 58232517

IUPAC6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N,4,11-hexakis-phenylindeno[1,2-b]fluorene-2,8-diamine
SMILESCC1(C)c2cc(N(c3ccccc3)c3ccccc3)ccc2-c2c1cc1c(c2-c2ccccc2)C(C)(C)c2cc(N(c3ccccc3)c3ccccc3)cc(-c3ccccc3)c2-1
InChIInChI=1S/C60H48N2/c1-59(2)52-38-47(61(43-27-15-7-16-28-43)44-29-17-8-18-30-44)35-36-49(52)57-54(59)40-51-56-50(41-23-11-5-12-24-41)37-48(62(45-31-19-9-20-32-45)46-33-21-10-22-34-46)39-53(56)60(3,4)58(51)55(57)42-25-13-6-14-26-42/h5-40H,1-4H3
InChIKeyMOGNLRYYMQQHKC-UHFFFAOYSA-N
MW797.06 g/mol
LogP16.57
Rot. Bonds8

About 6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N,4,11-hexakis-phenylindeno[1,2-b]fluorene-2,8-diamine

6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N,4,11-hexakis-phenylindeno[1,2-b]fluorene-2,8-diamine (PubChem CID 58232517) has the molecular formula C60H48N2 and a molecular weight of 797.06 g/mol. Its IUPAC name is 6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N,4,11-hexakis-phenylindeno[1,2-b]fluorene-2,8-diamine.

Molecular Properties

Compound Name6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N,4,11-hexakis-phenylindeno[1,2-b]fluorene-2,8-diamine
PubChem CID58232517
Molecular FormulaC60H48N2
Molecular Weight797.06 g/mol
Exact Mass796.38
IUPAC Name6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N,4,11-hexakis-phenylindeno[1,2-b]fluorene-2,8-diamine
SMILESCC1(C)c2cc(N(c3ccccc3)c3ccccc3)ccc2-c2c1cc1c(c2-c2ccccc2)C(C)(C)c2cc(N(c3ccccc3)c3ccccc3)cc(-c3ccccc3)c2-1
InChIInChI=1S/C60H48N2/c1-59(2)52-38-47(61(43-27-15-7-16-28-43)44-29-17-8-18-30-44)35-36-49(52)57-54(59)40-51-56-50(41-23-11-5-12-24-41)37-48(62(45-31-19-9-20-32-45)46-33-21-10-22-34-46)39-53(56)60(3,4)58(51)55(57)42-25-13-6-14-26-42/h5-40H,1-4H3
InChIKeyMOGNLRYYMQQHKC-UHFFFAOYSA-N
XLogP16.57
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500797.06
LogP ≤ 516.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-bis(9,9-dimethyl-5-phenylfluoren-2-yl)-9,9-dimethyl-5-phenylfluoren-2-amine
CID 170179873
9,9-dimethyl-5-phenyl-N,N-bis[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 155153854
4,6,6,11,12,12-hexamethyl-2-N,2-N,8-N,8-N-tetraphenylindeno[1,2-b]fluorene-2,8-diamine
CID 58232307
6,6,12,12-tetramethyl-N,10-diphenyl-N-[4-(4-phenylphenyl)phenyl]indeno[1,2-b]fluoren-2-amine
CID 138455850
3,3,24,24-tetramethyl-6-N,21-N-diphenyl-6-N,21-N-bis(4-phenylphenyl)hexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4(9),5,7,11,13,15,18(23),19,21-undecaene-6,21-diamine
CID 59182237
N,N-bis[4-(2,6-diphenylphenyl)phenyl]-9,9-dimethylfluoren-2-amine
CID 168771647
9,9-dimethyl-N-phenyl-N-[4-[4-(2,4,6-triphenylphenyl)phenyl]phenyl]fluoren-2-amine
CID 166676983
N-(9,9-dimethylfluoren-2-yl)-12',12'-dimethyl-N,5'-diphenylspiro[fluorene-9,10'-indeno[2,1-b]fluorene]-8'-amine
CID 171401786
1-N,3-N-bis(9,9-dimethylfluoren-2-yl)-5-[4-(2,6-diphenylphenyl)phenyl]-1-N,3-N-diphenylbenzene-1,3-diamine
CID 177286731
N,N-bis(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-5-phenylfluoren-3-amine
CID 169039545
11,11,12,12-tetramethyl-2-N,9-N,9-N-triphenyl-2-N-[3-[4-(N-[6,6,12,12-tetramethyl-8-(N-phenylanilino)indeno[1,2-b]fluoren-2-yl]anilino)phenyl]phenyl]indeno[2,1-a]fluorene-2,9-diamine
CID 134269456
6,6,12,12-tetramethyl-7-phenyl-N,N-bis(4-phenylphenyl)indeno[1,2-b]fluoren-2-amine
CID 138455813

Frequently Asked Questions

What is the IUPAC name of 6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N,4,11-hexakis-phenylindeno[1,2-b]fluorene-2,8-diamine?
The IUPAC name of 6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N,4,11-hexakis-phenylindeno[1,2-b]fluorene-2,8-diamine (CID 58232517) is 6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N,4,11-hexakis-phenylindeno[1,2-b]fluorene-2,8-diamine.
What is the SMILES notation for 6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N,4,11-hexakis-phenylindeno[1,2-b]fluorene-2,8-diamine?
The canonical SMILES for 6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N,4,11-hexakis-phenylindeno[1,2-b]fluorene-2,8-diamine is CC1(C)c2cc(N(c3ccccc3)c3ccccc3)ccc2-c2c1cc1c(c2-c2ccccc2)C(C)(C)c2cc(N(c3ccccc3)c3ccccc3)cc(-c3ccccc3)c2-1.
What is the InChIKey of 6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N,4,11-hexakis-phenylindeno[1,2-b]fluorene-2,8-diamine?
The InChIKey is MOGNLRYYMQQHKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H48N2/c1-59(2)52-38-47(61(43-27-15-7-16-28-43)44-29-17-8-18-30-44)35-36-49(52)57-54(59)40-51-56-50(41-23-11-5-12-24-41)37-48(62(45-31-19-9-20-32-45)46-33-21-10-22-34-46)39-53(56)60(3,4)58(51)55(57)42-25-13-6-14-26-42/h5-40H,1-4H3.
What are the key properties of 6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N,4,11-hexakis-phenylindeno[1,2-b]fluorene-2,8-diamine?
6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N,4,11-hexakis-phenylindeno[1,2-b]fluorene-2,8-diamine has a molecular weight of 797.06 g/mol, XLogP of 16.57, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N,4,11-hexakis-phenylindeno[1,2-b]fluorene-2,8-diamine is sourced from PubChem (CID 58232517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).