6,6,14,14-tetramethyl-3-N,3-N,9-N,9-N-tetrakis(3-phenylphenyl)tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene-3,9-diamine

C66H52N2 — CID 23561331

IUPAC6,6,14,14-tetramethyl-3-N,3-N,9-N,9-N-tetrakis(3-phenylphenyl)tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene-3,9-diamine
SMILESCC1(C)c2cc(N(c3cccc(-c4ccccc4)c3)c3cccc(-c4ccccc4)c3)cc3c2-c2c1cc(N(c1cccc(-c4ccccc4)c1)c1cccc(-c4ccccc4)c1)cc2C3(C)C
InChIInChI=1S/C66H52N2/c1-65(2)59-41-57(67(53-33-17-29-49(37-53)45-21-9-5-10-22-45)54-34-18-30-50(38-54)46-23-11-6-12-24-46)43-61-63(59)64-60(65)42-58(44-62(64)66(61,3)4)68(55-35-19-31-51(39-55)47-25-13-7-14-26-47)56-36-20-32-52(40-56)48-27-15-8-16-28-48/h5-44H,1-4H3
InChIKeyFTVCFRDRWXUQIB-UHFFFAOYSA-N
MW873.16 g/mol
LogP18.24
Rot. Bonds10

About 6,6,14,14-tetramethyl-3-N,3-N,9-N,9-N-tetrakis(3-phenylphenyl)tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene-3,9-diamine

6,6,14,14-tetramethyl-3-N,3-N,9-N,9-N-tetrakis(3-phenylphenyl)tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene-3,9-diamine (PubChem CID 23561331) has the molecular formula C66H52N2 and a molecular weight of 873.16 g/mol. Its IUPAC name is 6,6,14,14-tetramethyl-3-N,3-N,9-N,9-N-tetrakis(3-phenylphenyl)tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene-3,9-diamine.

Molecular Properties

Compound Name6,6,14,14-tetramethyl-3-N,3-N,9-N,9-N-tetrakis(3-phenylphenyl)tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene-3,9-diamine
PubChem CID23561331
Molecular FormulaC66H52N2
Molecular Weight873.16 g/mol
Exact Mass872.41
IUPAC Name6,6,14,14-tetramethyl-3-N,3-N,9-N,9-N-tetrakis(3-phenylphenyl)tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene-3,9-diamine
SMILESCC1(C)c2cc(N(c3cccc(-c4ccccc4)c3)c3cccc(-c4ccccc4)c3)cc3c2-c2c1cc(N(c1cccc(-c4ccccc4)c1)c1cccc(-c4ccccc4)c1)cc2C3(C)C
InChIInChI=1S/C66H52N2/c1-65(2)59-41-57(67(53-33-17-29-49(37-53)45-21-9-5-10-22-45)54-34-18-30-50(38-54)46-23-11-6-12-24-46)43-61-63(59)64-60(65)42-58(44-62(64)66(61,3)4)68(55-35-19-31-51(39-55)47-25-13-7-14-26-47)56-36-20-32-52(40-56)48-27-15-8-16-28-48/h5-44H,1-4H3
InChIKeyFTVCFRDRWXUQIB-UHFFFAOYSA-N
XLogP18.24
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms68
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500873.16
LogP ≤ 518.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 6,6,14,14-tetramethyl-3-N,3-N,9-N,9-N-tetrakis(3-phenylphenyl)tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene-3,9-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9,9-dimethyl-7-phenyl-N-(3-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 131994094
N-[4-[3-(N-(9,9-dimethylfluoren-2-yl)anilino)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
CID 169230595
4,6,6,10,12,12-hexamethyl-2-N,8-N-diphenyl-8-N-(4-phenylphenyl)-2-N-[4-(3-phenylphenyl)phenyl]indeno[1,2-b]fluorene-2,8-diamine
CID 90260304
3-phenyl-N-[3-[3-(N-phenylanilino)phenyl]phenyl]-N-(3-phenylphenyl)aniline
CID 126731391
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
N-(9,9-dimethyl-7-phenylfluoren-2-yl)-N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-9,9-dimethyl-7-phenylfluoren-2-amine
CID 118428449
2-N,2-N,7-N,7-N-tetrakis(9,9-dimethyl-7-phenylfluoren-2-yl)-9,9-dimethylfluorene-2,7-diamine
CID 20759573
6,6,14,14-tetramethyl-N,N-diphenyl-9-pyren-2-yltetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-3-amine
CID 146699452
3-(9,9-dimethylfluoren-4-yl)-N-[3-(9,9-dimethylfluoren-4-yl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline
CID 154972984
N-[3-(9,9-dimethylfluoren-3-yl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 138498501
9,9-dimethyl-N,N-bis(4-phenylphenyl)spiro[anthracene-10,9'-fluorene]-2'-amine;9,9-dimethyl-N-(3-phenylphenyl)-N-(4-phenylphenyl)spiro[anthracene-10,9'-fluorene]-2'-amine;9,9-dimethyl-N-phenyl-N-(4-phenylphenyl)spiro[anthracene-10,9'-fluorene]-2'-amine
CID 158705063
N-phenyl-3-(3-phenylphenyl)-N-[3-(3-phenylphenyl)phenyl]aniline
CID 166591076

Frequently Asked Questions

What is the IUPAC name of 6,6,14,14-tetramethyl-3-N,3-N,9-N,9-N-tetrakis(3-phenylphenyl)tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene-3,9-diamine?
The IUPAC name of 6,6,14,14-tetramethyl-3-N,3-N,9-N,9-N-tetrakis(3-phenylphenyl)tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene-3,9-diamine (CID 23561331) is 6,6,14,14-tetramethyl-3-N,3-N,9-N,9-N-tetrakis(3-phenylphenyl)tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene-3,9-diamine.
What is the SMILES notation for 6,6,14,14-tetramethyl-3-N,3-N,9-N,9-N-tetrakis(3-phenylphenyl)tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene-3,9-diamine?
The canonical SMILES for 6,6,14,14-tetramethyl-3-N,3-N,9-N,9-N-tetrakis(3-phenylphenyl)tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene-3,9-diamine is CC1(C)c2cc(N(c3cccc(-c4ccccc4)c3)c3cccc(-c4ccccc4)c3)cc3c2-c2c1cc(N(c1cccc(-c4ccccc4)c1)c1cccc(-c4ccccc4)c1)cc2C3(C)C.
What is the InChIKey of 6,6,14,14-tetramethyl-3-N,3-N,9-N,9-N-tetrakis(3-phenylphenyl)tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene-3,9-diamine?
The InChIKey is FTVCFRDRWXUQIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H52N2/c1-65(2)59-41-57(67(53-33-17-29-49(37-53)45-21-9-5-10-22-45)54-34-18-30-50(38-54)46-23-11-6-12-24-46)43-61-63(59)64-60(65)42-58(44-62(64)66(61,3)4)68(55-35-19-31-51(39-55)47-25-13-7-14-26-47)56-36-20-32-52(40-56)48-27-15-8-16-28-48/h5-44H,1-4H3.
What are the key properties of 6,6,14,14-tetramethyl-3-N,3-N,9-N,9-N-tetrakis(3-phenylphenyl)tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene-3,9-diamine?
6,6,14,14-tetramethyl-3-N,3-N,9-N,9-N-tetrakis(3-phenylphenyl)tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene-3,9-diamine has a molecular weight of 873.16 g/mol, XLogP of 18.24, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6,14,14-tetramethyl-3-N,3-N,9-N,9-N-tetrakis(3-phenylphenyl)tetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene-3,9-diamine is sourced from PubChem (CID 23561331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).