9-(6-methylcyclohexa-1,3-dien-1-yl)-N-[4-(1-methyl-9-phenyl-1,2-dihydrocarbazol-3-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)-1,9a-dihydrofluoren-2-amine

C63H52N2 — CID 146658014

IUPAC9-(6-methylcyclohexa-1,3-dien-1-yl)-N-[4-(1-methyl-9-phenyl-1,2-dihydrocarbazol-3-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)-1,9a-dihydrofluoren-2-amine
SMILESCC1CC=CC=C1C1(c2ccccc2)c2ccccc2C2=CC=C(N(c3ccc(C4=Cc5c(n(-c6ccccc6)c6ccccc56)C(C)C4)cc3)c3ccc(-c4ccccc4)cc3)CC21
InChIInChI=1S/C63H52N2/c1-43-18-12-15-27-58(43)63(49-21-8-4-9-22-49)59-28-16-13-25-54(59)55-39-38-53(42-60(55)63)64(51-34-30-46(31-35-51)45-19-6-3-7-20-45)52-36-32-47(33-37-52)48-40-44(2)62-57(41-48)56-26-14-17-29-61(56)65(62)50-23-10-5-11-24-50/h3-17,19-39,41,43-44,60H,18,40,42H2,1-2H3
InChIKeyGOYBJCRFHRCAGW-UHFFFAOYSA-N
MW837.12 g/mol
LogP16.29
Rot. Bonds8

About 9-(6-methylcyclohexa-1,3-dien-1-yl)-N-[4-(1-methyl-9-phenyl-1,2-dihydrocarbazol-3-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)-1,9a-dihydrofluoren-2-amine

9-(6-methylcyclohexa-1,3-dien-1-yl)-N-[4-(1-methyl-9-phenyl-1,2-dihydrocarbazol-3-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)-1,9a-dihydrofluoren-2-amine (PubChem CID 146658014) has the molecular formula C63H52N2 and a molecular weight of 837.12 g/mol. Its IUPAC name is 9-(6-methylcyclohexa-1,3-dien-1-yl)-N-[4-(1-methyl-9-phenyl-1,2-dihydrocarbazol-3-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)-1,9a-dihydrofluoren-2-amine.

Molecular Properties

Compound Name9-(6-methylcyclohexa-1,3-dien-1-yl)-N-[4-(1-methyl-9-phenyl-1,2-dihydrocarbazol-3-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)-1,9a-dihydrofluoren-2-amine
PubChem CID146658014
Molecular FormulaC63H52N2
Molecular Weight837.12 g/mol
Exact Mass836.41
IUPAC Name9-(6-methylcyclohexa-1,3-dien-1-yl)-N-[4-(1-methyl-9-phenyl-1,2-dihydrocarbazol-3-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)-1,9a-dihydrofluoren-2-amine
SMILESCC1CC=CC=C1C1(c2ccccc2)c2ccccc2C2=CC=C(N(c3ccc(C4=Cc5c(n(-c6ccccc6)c6ccccc56)C(C)C4)cc3)c3ccc(-c4ccccc4)cc3)CC21
InChIInChI=1S/C63H52N2/c1-43-18-12-15-27-58(43)63(49-21-8-4-9-22-49)59-28-16-13-25-54(59)55-39-38-53(42-60(55)63)64(51-34-30-46(31-35-51)45-19-6-3-7-20-45)52-36-32-47(33-37-52)48-40-44(2)62-57(41-48)56-26-14-17-29-61(56)65(62)50-23-10-5-11-24-50/h3-17,19-39,41,43-44,60H,18,40,42H2,1-2H3
InChIKeyGOYBJCRFHRCAGW-UHFFFAOYSA-N
XLogP16.29
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms65
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500837.12
LogP ≤ 516.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 9-(6-methylcyclohexa-1,3-dien-1-yl)-N-[4-(1-methyl-9-phenyl-1,2-dihydrocarbazol-3-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)-1,9a-dihydrofluoren-2-amine 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-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)-1,9a-dihydrofluoren-2-amine
CID 129228869
9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(3-phenylphenyl)-1,9a-dihydrofluoren-2-amine
CID 134361033
9,9-dimethyl-N-[4-(1-methyl-9-phenyl-1,2-dihydrocarbazol-3-yl)phenyl]-N-(4-pyridin-3-ylphenyl)fluoren-2-amine
CID 155064803
N-(4-bromophenyl)-N,9,9-triphenyl-1,9a-dihydrofluoren-2-amine
CID 144705202
9,9-dimethyl-N-[4-(9-phenyl-5,6-dihydrocarbazol-3-yl)phenyl]-N-(3-phenylphenyl)-1,9a-dihydrofluoren-2-amine
CID 167280862
9,9-dimethyl-N-[4-[3-methyl-2-[(1Z)-penta-1,4-dienyl]-1-phenylindol-5-yl]phenyl]-N-(4-phenylphenyl)-1,9a-dihydrofluoren-2-amine
CID 167046043
N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)-1,2-dihydrocarbazol-3-amine
CID 122691770
N-(1-methylspiro[1,9a-dihydrofluorene-9,9'-fluorene]-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-2-amine
CID 175624337
N-[(6S)-2-(1,13-diphenyl-13-pentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaenyl)-6-methylcyclohexa-1,3-dien-1-yl]-9-phenyl-N-(4-phenylphenyl)carbazol-2-amine
CID 145303098
N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)spiro[4b,5-dihydrofluorene-9,1'-cyclobutane]-3-amine
CID 144519701
3-[9-(9,9-dimethyl-1,9a-dihydrofluoren-2-yl)carbazol-3-yl]-6,9-diphenylcarbazole
CID 129298840
N-(9,9-diphenylfluoren-2-yl)-3,9-diphenyl-N-(4-phenylphenyl)carbazol-1-amine
CID 165155547

Frequently Asked Questions

What is the IUPAC name of 9-(6-methylcyclohexa-1,3-dien-1-yl)-N-[4-(1-methyl-9-phenyl-1,2-dihydrocarbazol-3-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)-1,9a-dihydrofluoren-2-amine?
The IUPAC name of 9-(6-methylcyclohexa-1,3-dien-1-yl)-N-[4-(1-methyl-9-phenyl-1,2-dihydrocarbazol-3-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)-1,9a-dihydrofluoren-2-amine (CID 146658014) is 9-(6-methylcyclohexa-1,3-dien-1-yl)-N-[4-(1-methyl-9-phenyl-1,2-dihydrocarbazol-3-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)-1,9a-dihydrofluoren-2-amine.
What is the SMILES notation for 9-(6-methylcyclohexa-1,3-dien-1-yl)-N-[4-(1-methyl-9-phenyl-1,2-dihydrocarbazol-3-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)-1,9a-dihydrofluoren-2-amine?
The canonical SMILES for 9-(6-methylcyclohexa-1,3-dien-1-yl)-N-[4-(1-methyl-9-phenyl-1,2-dihydrocarbazol-3-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)-1,9a-dihydrofluoren-2-amine is CC1CC=CC=C1C1(c2ccccc2)c2ccccc2C2=CC=C(N(c3ccc(C4=Cc5c(n(-c6ccccc6)c6ccccc56)C(C)C4)cc3)c3ccc(-c4ccccc4)cc3)CC21.
What is the InChIKey of 9-(6-methylcyclohexa-1,3-dien-1-yl)-N-[4-(1-methyl-9-phenyl-1,2-dihydrocarbazol-3-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)-1,9a-dihydrofluoren-2-amine?
The InChIKey is GOYBJCRFHRCAGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H52N2/c1-43-18-12-15-27-58(43)63(49-21-8-4-9-22-49)59-28-16-13-25-54(59)55-39-38-53(42-60(55)63)64(51-34-30-46(31-35-51)45-19-6-3-7-20-45)52-36-32-47(33-37-52)48-40-44(2)62-57(41-48)56-26-14-17-29-61(56)65(62)50-23-10-5-11-24-50/h3-17,19-39,41,43-44,60H,18,40,42H2,1-2H3.
What are the key properties of 9-(6-methylcyclohexa-1,3-dien-1-yl)-N-[4-(1-methyl-9-phenyl-1,2-dihydrocarbazol-3-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)-1,9a-dihydrofluoren-2-amine?
9-(6-methylcyclohexa-1,3-dien-1-yl)-N-[4-(1-methyl-9-phenyl-1,2-dihydrocarbazol-3-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)-1,9a-dihydrofluoren-2-amine has a molecular weight of 837.12 g/mol, XLogP of 16.29, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(6-methylcyclohexa-1,3-dien-1-yl)-N-[4-(1-methyl-9-phenyl-1,2-dihydrocarbazol-3-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)-1,9a-dihydrofluoren-2-amine is sourced from PubChem (CID 146658014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).