4-N'-cyclohexa-1,5-dien-1-yl-2-N-phenyl-4-N'-(6-phenylcyclohexa-2,4-dien-1-yl)-2-N-(4-phenylphenyl)spiro[7,8-dihydrofluorene-9,9'-fluorene]-2,4'-diamine

C61H48N2 — CID 135218208

IUPAC4-N'-cyclohexa-1,5-dien-1-yl-2-N-phenyl-4-N'-(6-phenylcyclohexa-2,4-dien-1-yl)-2-N-(4-phenylphenyl)spiro[7,8-dihydrofluorene-9,9'-fluorene]-2,4'-diamine
SMILESC1=CC(c2ccccc2)C(N(C2=CCCC=C2)c2cccc3c2-c2ccccc2C32C3=C(C=CCC3)c3ccc(N(c4ccccc4)c4ccc(-c5ccccc5)cc4)cc32)C=C1
InChIInChI=1S/C61H48N2/c1-5-20-43(21-6-1)44-36-38-48(39-37-44)62(46-24-9-3-10-25-46)49-40-41-52-51-29-13-16-31-54(51)61(57(52)42-49)55-32-17-14-30-53(55)60-56(61)33-19-35-59(60)63(47-26-11-4-12-27-47)58-34-18-15-28-50(58)45-22-7-2-8-23-45/h1-3,5-11,13-15,17-30,32-42,50,58H,4,12,16,31H2
InChIKeyLHCCSAOQTQQKTF-UHFFFAOYSA-N
MW809.07 g/mol
LogP15.57
Rot. Bonds8

About 4-N'-cyclohexa-1,5-dien-1-yl-2-N-phenyl-4-N'-(6-phenylcyclohexa-2,4-dien-1-yl)-2-N-(4-phenylphenyl)spiro[7,8-dihydrofluorene-9,9'-fluorene]-2,4'-diamine

4-N'-cyclohexa-1,5-dien-1-yl-2-N-phenyl-4-N'-(6-phenylcyclohexa-2,4-dien-1-yl)-2-N-(4-phenylphenyl)spiro[7,8-dihydrofluorene-9,9'-fluorene]-2,4'-diamine (PubChem CID 135218208) has the molecular formula C61H48N2 and a molecular weight of 809.07 g/mol. Its IUPAC name is 4-N'-cyclohexa-1,5-dien-1-yl-2-N-phenyl-4-N'-(6-phenylcyclohexa-2,4-dien-1-yl)-2-N-(4-phenylphenyl)spiro[7,8-dihydrofluorene-9,9'-fluorene]-2,4'-diamine.

Molecular Properties

Compound Name4-N'-cyclohexa-1,5-dien-1-yl-2-N-phenyl-4-N'-(6-phenylcyclohexa-2,4-dien-1-yl)-2-N-(4-phenylphenyl)spiro[7,8-dihydrofluorene-9,9'-fluorene]-2,4'-diamine
PubChem CID135218208
Molecular FormulaC61H48N2
Molecular Weight809.07 g/mol
Exact Mass808.38
IUPAC Name4-N'-cyclohexa-1,5-dien-1-yl-2-N-phenyl-4-N'-(6-phenylcyclohexa-2,4-dien-1-yl)-2-N-(4-phenylphenyl)spiro[7,8-dihydrofluorene-9,9'-fluorene]-2,4'-diamine
SMILESC1=CC(c2ccccc2)C(N(C2=CCCC=C2)c2cccc3c2-c2ccccc2C32C3=C(C=CCC3)c3ccc(N(c4ccccc4)c4ccc(-c5ccccc5)cc4)cc32)C=C1
InChIInChI=1S/C61H48N2/c1-5-20-43(21-6-1)44-36-38-48(39-37-44)62(46-24-9-3-10-25-46)49-40-41-52-51-29-13-16-31-54(51)61(57(52)42-49)55-32-17-14-30-53(55)60-56(61)33-19-35-59(60)63(47-26-11-4-12-27-47)58-34-18-15-28-50(58)45-22-7-2-8-23-45/h1-3,5-11,13-15,17-30,32-42,50,58H,4,12,16,31H2
InChIKeyLHCCSAOQTQQKTF-UHFFFAOYSA-N
XLogP15.57
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms63
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500809.07
LogP ≤ 515.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-N'-cyclohexa-1,5-dien-1-yl-2-N-phenyl-4-N'-(6-phenylcyclohexa-2,4-dien-1-yl)-2-N-(4-phenylphenyl)spiro[7,8-dihydrofluorene-9,9'-fluorene]-2,4'-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

7'-chloro-N,N-bis(4-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-1'-amine
CID 142521254
N,4-diphenyl-N-[4-[4-(9-phenyl-1,2-dihydrofluoren-9-yl)phenyl]phenyl]aniline
CID 70822820
N-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenoxy]phenyl]-N-(4-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-4'-amine
CID 123261989
N-(2-phenylphenyl)-N-(4-phenylphenyl)spiro[1,2-dihydrofluorene-9,10'-14,21-dioxapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene]-16'-amine
CID 138581502
2-N'-phenyl-4-N-(3-phenylphenyl)-2-N',4-N-bis(4-phenylphenyl)-9,9'-spirobi[fluorene]-2',4-diamine
CID 140915431
2-N'-phenyl-2-N'-(3-phenylphenyl)-4-N,4-N-bis(4-phenylphenyl)-9,9'-spirobi[fluorene]-2',4-diamine
CID 140915444
N-(9',9'-dimethylspiro[7,8-dihydrofluorene-9,10'-anthracene]-2-yl)-N-(4-phenylphenyl)dibenzothiophen-2-amine
CID 142480985
2-N'-(5-methylcyclohexa-1,5-dien-1-yl)-7-N'-(3-methylphenyl)-2-N',7-N'-diphenyl-9,9'-spirobi[1,2-dihydrofluorene]-2',7'-diamine
CID 130371077
N-(9,9-dimethylfluoren-2-yl)-5-phenyl-N-(3-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-3'-amine
CID 145331604
9,9-dimethyl-N-(2-phenylphenyl)-N-(4-spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2(7),3,8,10,12,15,17-octaene]-4-ylphenyl)fluoren-2-amine
CID 121391863
2-cyclohexa-1,5-dien-1-yl-N-[4-[4'-[4-[cyclohexa-1,3-dien-1-yl(cyclohexa-1,5-dien-1-yl)amino]phenyl]spiro[1,2-dihydrofluorene-9,9'-fluorene]-2-yl]phenyl]-N-phenylaniline
CID 145290993
7-N'-(2,5-dimethylcyclohex-3-en-1-yl)-2-N'-(3-methylphenyl)-2-N',7-N'-diphenylspiro[1,2-dihydrofluorene-9,9'-fluorene]-2',7'-diamine
CID 175611283

Frequently Asked Questions

What is the IUPAC name of 4-N'-cyclohexa-1,5-dien-1-yl-2-N-phenyl-4-N'-(6-phenylcyclohexa-2,4-dien-1-yl)-2-N-(4-phenylphenyl)spiro[7,8-dihydrofluorene-9,9'-fluorene]-2,4'-diamine?
The IUPAC name of 4-N'-cyclohexa-1,5-dien-1-yl-2-N-phenyl-4-N'-(6-phenylcyclohexa-2,4-dien-1-yl)-2-N-(4-phenylphenyl)spiro[7,8-dihydrofluorene-9,9'-fluorene]-2,4'-diamine (CID 135218208) is 4-N'-cyclohexa-1,5-dien-1-yl-2-N-phenyl-4-N'-(6-phenylcyclohexa-2,4-dien-1-yl)-2-N-(4-phenylphenyl)spiro[7,8-dihydrofluorene-9,9'-fluorene]-2,4'-diamine.
What is the SMILES notation for 4-N'-cyclohexa-1,5-dien-1-yl-2-N-phenyl-4-N'-(6-phenylcyclohexa-2,4-dien-1-yl)-2-N-(4-phenylphenyl)spiro[7,8-dihydrofluorene-9,9'-fluorene]-2,4'-diamine?
The canonical SMILES for 4-N'-cyclohexa-1,5-dien-1-yl-2-N-phenyl-4-N'-(6-phenylcyclohexa-2,4-dien-1-yl)-2-N-(4-phenylphenyl)spiro[7,8-dihydrofluorene-9,9'-fluorene]-2,4'-diamine is C1=CC(c2ccccc2)C(N(C2=CCCC=C2)c2cccc3c2-c2ccccc2C32C3=C(C=CCC3)c3ccc(N(c4ccccc4)c4ccc(-c5ccccc5)cc4)cc32)C=C1.
What is the InChIKey of 4-N'-cyclohexa-1,5-dien-1-yl-2-N-phenyl-4-N'-(6-phenylcyclohexa-2,4-dien-1-yl)-2-N-(4-phenylphenyl)spiro[7,8-dihydrofluorene-9,9'-fluorene]-2,4'-diamine?
The InChIKey is LHCCSAOQTQQKTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H48N2/c1-5-20-43(21-6-1)44-36-38-48(39-37-44)62(46-24-9-3-10-25-46)49-40-41-52-51-29-13-16-31-54(51)61(57(52)42-49)55-32-17-14-30-53(55)60-56(61)33-19-35-59(60)63(47-26-11-4-12-27-47)58-34-18-15-28-50(58)45-22-7-2-8-23-45/h1-3,5-11,13-15,17-30,32-42,50,58H,4,12,16,31H2.
What are the key properties of 4-N'-cyclohexa-1,5-dien-1-yl-2-N-phenyl-4-N'-(6-phenylcyclohexa-2,4-dien-1-yl)-2-N-(4-phenylphenyl)spiro[7,8-dihydrofluorene-9,9'-fluorene]-2,4'-diamine?
4-N'-cyclohexa-1,5-dien-1-yl-2-N-phenyl-4-N'-(6-phenylcyclohexa-2,4-dien-1-yl)-2-N-(4-phenylphenyl)spiro[7,8-dihydrofluorene-9,9'-fluorene]-2,4'-diamine has a molecular weight of 809.07 g/mol, XLogP of 15.57, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N'-cyclohexa-1,5-dien-1-yl-2-N-phenyl-4-N'-(6-phenylcyclohexa-2,4-dien-1-yl)-2-N-(4-phenylphenyl)spiro[7,8-dihydrofluorene-9,9'-fluorene]-2,4'-diamine is sourced from PubChem (CID 135218208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).