7-N,19-N-di(dibenzofuran-3-yl)-7-N,19-N,10,10,22,22-hexakis-phenylhexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3(11),4(9),5,7,12,14,16(21),17,19,23-undecaene-7,19-diamine

C84H54N2O2 — CID 163556957

IUPAC7-N,19-N-di(dibenzofuran-3-yl)-7-N,19-N,10,10,22,22-hexakis-phenylhexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3(11),4(9),5,7,12,14,16(21),17,19,23-undecaene-7,19-diamine
SMILESc1ccc(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc4cc5c(cc4cc2-3)C(c2ccccc2)(c2ccccc2)c2cc(N(c3ccccc3)c3ccc4c(c3)oc3ccccc34)ccc2-5)c2ccc3c(c2)oc2ccccc23)cc1
InChIInChI=1S/C84H54N2O2/c1-7-23-57(24-8-1)83(58-25-9-2-10-26-58)75-49-55-48-74-68-44-40-64(86(62-33-17-6-18-34-62)66-42-46-72-70-36-20-22-38-80(70)88-82(72)54-66)52-78(68)84(59-27-11-3-12-28-59,60-29-13-4-14-30-60)76(74)50-56(55)47-73(75)67-43-39-63(51-77(67)83)85(61-31-15-5-16-32-61)65-41-45-71-69-35-19-21-37-79(69)87-81(71)53-65/h1-54H
InChIKeyFNWRWLAZDCPRQM-UHFFFAOYSA-N
MW1123.37 g/mol
LogP22.30
Rot. Bonds10

About 7-N,19-N-di(dibenzofuran-3-yl)-7-N,19-N,10,10,22,22-hexakis-phenylhexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3(11),4(9),5,7,12,14,16(21),17,19,23-undecaene-7,19-diamine

7-N,19-N-di(dibenzofuran-3-yl)-7-N,19-N,10,10,22,22-hexakis-phenylhexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3(11),4(9),5,7,12,14,16(21),17,19,23-undecaene-7,19-diamine (PubChem CID 163556957) has the molecular formula C84H54N2O2 and a molecular weight of 1123.37 g/mol. Its IUPAC name is 7-N,19-N-di(dibenzofuran-3-yl)-7-N,19-N,10,10,22,22-hexakis-phenylhexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3(11),4(9),5,7,12,14,16(21),17,19,23-undecaene-7,19-diamine.

Molecular Properties

Compound Name7-N,19-N-di(dibenzofuran-3-yl)-7-N,19-N,10,10,22,22-hexakis-phenylhexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3(11),4(9),5,7,12,14,16(21),17,19,23-undecaene-7,19-diamine
PubChem CID163556957
Molecular FormulaC84H54N2O2
Molecular Weight1123.37 g/mol
Exact Mass1122.42
IUPAC Name7-N,19-N-di(dibenzofuran-3-yl)-7-N,19-N,10,10,22,22-hexakis-phenylhexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3(11),4(9),5,7,12,14,16(21),17,19,23-undecaene-7,19-diamine
SMILESc1ccc(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc4cc5c(cc4cc2-3)C(c2ccccc2)(c2ccccc2)c2cc(N(c3ccccc3)c3ccc4c(c3)oc3ccccc34)ccc2-5)c2ccc3c(c2)oc2ccccc23)cc1
InChIInChI=1S/C84H54N2O2/c1-7-23-57(24-8-1)83(58-25-9-2-10-26-58)75-49-55-48-74-68-44-40-64(86(62-33-17-6-18-34-62)66-42-46-72-70-36-20-22-38-80(70)88-82(72)54-66)52-78(68)84(59-27-11-3-12-28-59,60-29-13-4-14-30-60)76(74)50-56(55)47-73(75)67-43-39-63(51-77(67)83)85(61-31-15-5-16-32-61)65-41-45-71-69-35-19-21-37-79(69)87-81(71)53-65/h1-54H
InChIKeyFNWRWLAZDCPRQM-UHFFFAOYSA-N
XLogP22.30
TPSA32.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms88
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001123.37
LogP ≤ 522.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 7-N,19-N-di(dibenzofuran-3-yl)-7-N,19-N,10,10,22,22-hexakis-phenylhexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3(11),4(9),5,7,12,14,16(21),17,19,23-undecaene-7,19-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

N-(10,10-diphenyl-17-pentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14(19),15,17,20-decaenyl)-N-phenyldibenzofuran-3-amine
CID 168740238
N-phenyl-N-[4-(14-phenyl-6-oxatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaen-14-yl)phenyl]dibenzofuran-3-amine
CID 129230912
N-(9-dibenzofuran-2-yl-9-phenylfluoren-2-yl)-N,9,9-triphenylfluoren-2-amine
CID 134452942
3-N-dibenzofuran-1-yl-1-N-dibenzofuran-3-yl-3-N-(9,9-diphenylfluoren-2-yl)-1-N-(9,9-diphenylfluoren-3-yl)benzene-1,3-diamine
CID 155312532
4-(4-dibenzofuran-3-ylphenyl)-N-[4-(9,9-diphenylfluoren-2-yl)phenyl]-N-phenylaniline
CID 67964130
N-dibenzofuran-3-yl-N-[9,9-diphenyl-6-(9-phenylfluoren-9-yl)fluoren-3-yl]dibenzofuran-3-amine
CID 140919850
N-(9,9-diphenylfluoren-2-yl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzofuran-3-amine
CID 166565747
N-(9,9-diphenylfluoren-3-yl)-N-(9,9'-spirobi[fluorene]-2-yl)dibenzofuran-2-amine
CID 121423669
N-dibenzofuran-3-yl-N-[9,9-dimethyl-7-(9-phenylfluoren-9-yl)fluoren-2-yl]dibenzofuran-3-amine
CID 140919912
N-[4-(9,9-diphenylfluoren-2-yl)phenyl]-N-(9-methyl-9-phenylfluoren-2-yl)dibenzofuran-3-amine
CID 171453577
N-(4-dibenzofuran-3-ylphenyl)-4-(9,9-diphenylfluoren-3-yl)-N-phenylaniline
CID 168839753
8-N,22-N-bis(9,9-diphenylfluoren-2-yl)-8-N,22-N-bis(4-fluorophenyl)-5,15,25-trioxaheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19(24),20,22,26-dodecaene-8,22-diamine
CID 165026586

Frequently Asked Questions

What is the IUPAC name of 7-N,19-N-di(dibenzofuran-3-yl)-7-N,19-N,10,10,22,22-hexakis-phenylhexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3(11),4(9),5,7,12,14,16(21),17,19,23-undecaene-7,19-diamine?
The IUPAC name of 7-N,19-N-di(dibenzofuran-3-yl)-7-N,19-N,10,10,22,22-hexakis-phenylhexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3(11),4(9),5,7,12,14,16(21),17,19,23-undecaene-7,19-diamine (CID 163556957) is 7-N,19-N-di(dibenzofuran-3-yl)-7-N,19-N,10,10,22,22-hexakis-phenylhexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3(11),4(9),5,7,12,14,16(21),17,19,23-undecaene-7,19-diamine.
What is the SMILES notation for 7-N,19-N-di(dibenzofuran-3-yl)-7-N,19-N,10,10,22,22-hexakis-phenylhexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3(11),4(9),5,7,12,14,16(21),17,19,23-undecaene-7,19-diamine?
The canonical SMILES for 7-N,19-N-di(dibenzofuran-3-yl)-7-N,19-N,10,10,22,22-hexakis-phenylhexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3(11),4(9),5,7,12,14,16(21),17,19,23-undecaene-7,19-diamine is c1ccc(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc4cc5c(cc4cc2-3)C(c2ccccc2)(c2ccccc2)c2cc(N(c3ccccc3)c3ccc4c(c3)oc3ccccc34)ccc2-5)c2ccc3c(c2)oc2ccccc23)cc1.
What is the InChIKey of 7-N,19-N-di(dibenzofuran-3-yl)-7-N,19-N,10,10,22,22-hexakis-phenylhexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3(11),4(9),5,7,12,14,16(21),17,19,23-undecaene-7,19-diamine?
The InChIKey is FNWRWLAZDCPRQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C84H54N2O2/c1-7-23-57(24-8-1)83(58-25-9-2-10-26-58)75-49-55-48-74-68-44-40-64(86(62-33-17-6-18-34-62)66-42-46-72-70-36-20-22-38-80(70)88-82(72)54-66)52-78(68)84(59-27-11-3-12-28-59,60-29-13-4-14-30-60)76(74)50-56(55)47-73(75)67-43-39-63(51-77(67)83)85(61-31-15-5-16-32-61)65-41-45-71-69-35-19-21-37-79(69)87-81(71)53-65/h1-54H.
What are the key properties of 7-N,19-N-di(dibenzofuran-3-yl)-7-N,19-N,10,10,22,22-hexakis-phenylhexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3(11),4(9),5,7,12,14,16(21),17,19,23-undecaene-7,19-diamine?
7-N,19-N-di(dibenzofuran-3-yl)-7-N,19-N,10,10,22,22-hexakis-phenylhexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3(11),4(9),5,7,12,14,16(21),17,19,23-undecaene-7,19-diamine has a molecular weight of 1123.37 g/mol, XLogP of 22.30, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-N,19-N-di(dibenzofuran-3-yl)-7-N,19-N,10,10,22,22-hexakis-phenylhexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3(11),4(9),5,7,12,14,16(21),17,19,23-undecaene-7,19-diamine is sourced from PubChem (CID 163556957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).