N-(4-dibenzofuran-4-yl-4-methylcyclohexa-1,5-dien-1-yl)-10-phenyl-N-(4-phenylphenyl)-6,6,12,12-tetra(propan-2-yl)indeno[1,2-b]fluoren-2-amine;ethane

C71H71NO — CID 142541181

IUPACN-(4-dibenzofuran-4-yl-4-methylcyclohexa-1,5-dien-1-yl)-10-phenyl-N-(4-phenylphenyl)-6,6,12,12-tetra(propan-2-yl)indeno[1,2-b]fluoren-2-amine;ethane
SMILESCC.CC(C)C1(C(C)C)c2cc(N(C3=CCC(C)(c4cccc5c4oc4ccccc45)C=C3)c3ccc(-c4ccccc4)cc3)ccc2-c2cc3c(cc21)-c1c(-c2ccccc2)cccc1C3(C(C)C)C(C)C
InChIInChI=1S/C69H65NO.C2H6/c1-43(2)68(44(3)4)59-27-18-25-53(49-22-14-11-15-23-49)65(59)58-42-62-57(41-63(58)68)54-35-34-52(40-61(54)69(62,45(5)6)46(7)8)70(50-32-30-48(31-33-50)47-20-12-10-13-21-47)51-36-38-67(9,39-37-51)60-28-19-26-56-55-24-16-17-29-64(55)71-66(56)60;1-2/h10-38,40-46H,39H2,1-9H3;1-2H3
InChIKeyKEXLAAXBWWQRQX-UHFFFAOYSA-N
MW954.35 g/mol
LogP20.04
Rot. Bonds10

About N-(4-dibenzofuran-4-yl-4-methylcyclohexa-1,5-dien-1-yl)-10-phenyl-N-(4-phenylphenyl)-6,6,12,12-tetra(propan-2-yl)indeno[1,2-b]fluoren-2-amine;ethane

N-(4-dibenzofuran-4-yl-4-methylcyclohexa-1,5-dien-1-yl)-10-phenyl-N-(4-phenylphenyl)-6,6,12,12-tetra(propan-2-yl)indeno[1,2-b]fluoren-2-amine;ethane (PubChem CID 142541181) has the molecular formula C71H71NO and a molecular weight of 954.35 g/mol. Its IUPAC name is N-(4-dibenzofuran-4-yl-4-methylcyclohexa-1,5-dien-1-yl)-10-phenyl-N-(4-phenylphenyl)-6,6,12,12-tetra(propan-2-yl)indeno[1,2-b]fluoren-2-amine;ethane.

Molecular Properties

Compound NameN-(4-dibenzofuran-4-yl-4-methylcyclohexa-1,5-dien-1-yl)-10-phenyl-N-(4-phenylphenyl)-6,6,12,12-tetra(propan-2-yl)indeno[1,2-b]fluoren-2-amine;ethane
PubChem CID142541181
Molecular FormulaC71H71NO
Molecular Weight954.35 g/mol
Exact Mass953.55
IUPAC NameN-(4-dibenzofuran-4-yl-4-methylcyclohexa-1,5-dien-1-yl)-10-phenyl-N-(4-phenylphenyl)-6,6,12,12-tetra(propan-2-yl)indeno[1,2-b]fluoren-2-amine;ethane
SMILESCC.CC(C)C1(C(C)C)c2cc(N(C3=CCC(C)(c4cccc5c4oc4ccccc45)C=C3)c3ccc(-c4ccccc4)cc3)ccc2-c2cc3c(cc21)-c1c(-c2ccccc2)cccc1C3(C(C)C)C(C)C
InChIInChI=1S/C69H65NO.C2H6/c1-43(2)68(44(3)4)59-27-18-25-53(49-22-14-11-15-23-49)65(59)58-42-62-57(41-63(58)68)54-35-34-52(40-61(54)69(62,45(5)6)46(7)8)70(50-32-30-48(31-33-50)47-20-12-10-13-21-47)51-36-38-67(9,39-37-51)60-28-19-26-56-55-24-16-17-29-64(55)71-66(56)60;1-2/h10-38,40-46H,39H2,1-9H3;1-2H3
InChIKeyKEXLAAXBWWQRQX-UHFFFAOYSA-N
XLogP20.04
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms73
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500954.35
LogP ≤ 520.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-(4-dibenzofuran-4-yl-4-methylcyclohexa-1,5-dien-1-yl)-10-phenyl-N-(4-phenylphenyl)-6,6,12,12-tetra(propan-2-yl)indeno[1,2-b]fluoren-2-amine;ethane with MolForge

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Related Compounds

N-(4-dibenzofuran-4-ylphenyl)-N-phenyl-4-[4-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-4-yl)phenyl]aniline
CID 155095551
3-(4-dibenzofuran-4-ylphenyl)-6,6,12,12-tetramethyl-N-(4-methyl-4-phenylcyclohexa-1,5-dien-1-yl)-N-phenylindeno[2,1-h]fluoren-1-amine
CID 142540819
N,4-bis(4-dibenzofuran-4-ylphenyl)-6,6,12,12-tetramethyl-N-(4-phenylphenyl)indeno[1,2-b]fluoren-2-amine
CID 169284394
8-dibenzofuran-4-yl-N-(9,9-dimethylfluoren-2-yl)-6,6,12,12-tetramethyl-N-[4-(4-phenylphenyl)phenyl]indeno[1,2-b]fluoren-2-amine
CID 88534252
N-(4-dibenzofuran-4-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-7-phenylfluoren-2-amine
CID 67964252
N-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-9,9-dimethyl-7-phenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 67964106
N-[4-(9-dibenzofuran-4-yl-3,4-dihydrofluoren-9-yl)phenyl]-N-(4-methyl-4-phenylcyclohexa-1,5-dien-1-yl)-4-phenylaniline
CID 144960334
N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[2-[3-phenyl-2-(2-phenylphenyl)phenyl]phenyl]fluoren-2-amine
CID 168789334
N-[4-(3-dibenzofuran-4-ylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 67964212
N-(7-dibenzofuran-4-yl-9,9-dimethylfluoren-2-yl)-9,9-dimethyl-7-phenyl-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine;N-(7-dibenzofuran-4-yl-9,9-dimethylfluoren-2-yl)-9,9-dimethyl-7-phenyl-N-[4-(3-phenylphenyl)phenyl]fluoren-2-amine;N-(7-dibenzofuran-4-yl-9,9-dimethylfluoren-2-yl)-9,9-dimethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-9,9-dimethyl-7-phenyl-N-[4-(2-phenylphenyl)phenyl]fluoren-2-amine;N-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-9,9-dimethyl-7-phenyl-N-[4-(3-phenylphenyl)phenyl]fluoren-2-amine;N-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-9,9-dimethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 161143878
N-(4-dibenzofuran-4-ylphenyl)-15,15,25,25-tetramethyl-N-(15,15,25,25-tetramethyl-10-oxaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19(24),20,22,26-dodecaen-22-yl)-10-oxaheptacyclo[14.11.0.02,14.03,11.04,9.018,26.019,24]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19(24),20,22,26-dodecaen-22-amine
CID 155088984
N-[9,9-dimethyl-5-(2-phenylphenyl)fluoren-2-yl]-N-(4-phenylphenyl)dibenzofuran-4-amine
CID 138724001

Frequently Asked Questions

What is the IUPAC name of N-(4-dibenzofuran-4-yl-4-methylcyclohexa-1,5-dien-1-yl)-10-phenyl-N-(4-phenylphenyl)-6,6,12,12-tetra(propan-2-yl)indeno[1,2-b]fluoren-2-amine;ethane?
The IUPAC name of N-(4-dibenzofuran-4-yl-4-methylcyclohexa-1,5-dien-1-yl)-10-phenyl-N-(4-phenylphenyl)-6,6,12,12-tetra(propan-2-yl)indeno[1,2-b]fluoren-2-amine;ethane (CID 142541181) is N-(4-dibenzofuran-4-yl-4-methylcyclohexa-1,5-dien-1-yl)-10-phenyl-N-(4-phenylphenyl)-6,6,12,12-tetra(propan-2-yl)indeno[1,2-b]fluoren-2-amine;ethane.
What is the SMILES notation for N-(4-dibenzofuran-4-yl-4-methylcyclohexa-1,5-dien-1-yl)-10-phenyl-N-(4-phenylphenyl)-6,6,12,12-tetra(propan-2-yl)indeno[1,2-b]fluoren-2-amine;ethane?
The canonical SMILES for N-(4-dibenzofuran-4-yl-4-methylcyclohexa-1,5-dien-1-yl)-10-phenyl-N-(4-phenylphenyl)-6,6,12,12-tetra(propan-2-yl)indeno[1,2-b]fluoren-2-amine;ethane is CC.CC(C)C1(C(C)C)c2cc(N(C3=CCC(C)(c4cccc5c4oc4ccccc45)C=C3)c3ccc(-c4ccccc4)cc3)ccc2-c2cc3c(cc21)-c1c(-c2ccccc2)cccc1C3(C(C)C)C(C)C.
What is the InChIKey of N-(4-dibenzofuran-4-yl-4-methylcyclohexa-1,5-dien-1-yl)-10-phenyl-N-(4-phenylphenyl)-6,6,12,12-tetra(propan-2-yl)indeno[1,2-b]fluoren-2-amine;ethane?
The InChIKey is KEXLAAXBWWQRQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C69H65NO.C2H6/c1-43(2)68(44(3)4)59-27-18-25-53(49-22-14-11-15-23-49)65(59)58-42-62-57(41-63(58)68)54-35-34-52(40-61(54)69(62,45(5)6)46(7)8)70(50-32-30-48(31-33-50)47-20-12-10-13-21-47)51-36-38-67(9,39-37-51)60-28-19-26-56-55-24-16-17-29-64(55)71-66(56)60;1-2/h10-38,40-46H,39H2,1-9H3;1-2H3.
What are the key properties of N-(4-dibenzofuran-4-yl-4-methylcyclohexa-1,5-dien-1-yl)-10-phenyl-N-(4-phenylphenyl)-6,6,12,12-tetra(propan-2-yl)indeno[1,2-b]fluoren-2-amine;ethane?
N-(4-dibenzofuran-4-yl-4-methylcyclohexa-1,5-dien-1-yl)-10-phenyl-N-(4-phenylphenyl)-6,6,12,12-tetra(propan-2-yl)indeno[1,2-b]fluoren-2-amine;ethane has a molecular weight of 954.35 g/mol, XLogP of 20.04, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-dibenzofuran-4-yl-4-methylcyclohexa-1,5-dien-1-yl)-10-phenyl-N-(4-phenylphenyl)-6,6,12,12-tetra(propan-2-yl)indeno[1,2-b]fluoren-2-amine;ethane is sourced from PubChem (CID 142541181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).