N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzothiophen-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)-9-phenylcarbazol-1-amine

C210H145N5O2S — CID 165068649

IUPACN-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzothiophen-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)-9-phenylcarbazol-1-amine
SMILESCC1(C)c2ccc(N(c3ccc4ccccc4c3-c3ccc4ccccc4c3)c3cccc4c3oc3ccccc34)cc2-c2cc3ccccc3cc21.CC1(C)c2ccc(N(c3ccc4ccccc4c3-c3ccc4ccccc4c3)c3cccc4c3sc3ccccc34)cc2-c2cc3ccccc3cc21.CC1(C)c2ccc(N(c3ccc4ccccc4c3-c3ccc4ccccc4c3)c3cccc4c5ccccc5n(-c5ccccc5)c34)cc2-c2cc3ccccc3cc21.CC1(C)c2ccc(N(c3ccc4ccccc4c3-c3ccc4ccccc4c3)c3cccc4oc5ccccc5c34)cc2-c2cc3ccccc3cc21
InChIInChI=1S/C57H40N2.2C51H35NO.C51H35NS/c1-57(2)50-31-30-44(36-49(50)48-34-40-18-8-9-19-41(40)35-51(48)57)58(54-26-14-24-47-46-23-12-13-25-52(46)59(56(47)54)43-20-4-3-5-21-43)53-32-29-38-16-10-11-22-45(38)55(53)42-28-27-37-15-6-7-17-39(37)33-42;1-51(2)44-26-25-38(31-43(44)42-29-35-15-5-6-16-36(35)30-45(42)51)52(47-20-11-19-41-40-18-9-10-21-48(40)53-50(41)47)46-27-24-33-13-7-8-17-39(33)49(46)37-23-22-32-12-3-4-14-34(32)28-37;1-51(2)43-26-25-38(31-42(43)41-29-35-15-5-6-16-36(35)30-44(41)51)52(45-19-11-21-48-50(45)40-18-9-10-20-47(40)53-48)46-27-24-33-13-7-8-17-39(33)49(46)37-23-22-32-12-3-4-14-34(32)28-37;1-51(2)44-26-25-38(31-43(44)42-29-35-15-5-6-16-36(35)30-45(42)51)52(47-20-11-19-41-40-18-9-10-21-48(40)53-50(41)47)46-27-24-33-13-7-8-17-39(33)49(46)37-23-22-32-12-3-4-14-34(32)28-37/h3-36H,1-2H3;3*3-31H,1-2H3
InChIKeySJQCGSWLVPVYDD-UHFFFAOYSA-N
MW2802.57 g/mol
LogP59.62
Rot. Bonds17

About N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzothiophen-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)-9-phenylcarbazol-1-amine

N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzothiophen-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)-9-phenylcarbazol-1-amine (PubChem CID 165068649) has the molecular formula C210H145N5O2S and a molecular weight of 2802.57 g/mol. Its IUPAC name is N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzothiophen-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)-9-phenylcarbazol-1-amine.

Molecular Properties

Compound NameN-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzothiophen-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)-9-phenylcarbazol-1-amine
PubChem CID165068649
Molecular FormulaC210H145N5O2S
Molecular Weight2802.57 g/mol
Exact Mass2800.11
IUPAC NameN-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzothiophen-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)-9-phenylcarbazol-1-amine
SMILESCC1(C)c2ccc(N(c3ccc4ccccc4c3-c3ccc4ccccc4c3)c3cccc4c3oc3ccccc34)cc2-c2cc3ccccc3cc21.CC1(C)c2ccc(N(c3ccc4ccccc4c3-c3ccc4ccccc4c3)c3cccc4c3sc3ccccc34)cc2-c2cc3ccccc3cc21.CC1(C)c2ccc(N(c3ccc4ccccc4c3-c3ccc4ccccc4c3)c3cccc4c5ccccc5n(-c5ccccc5)c34)cc2-c2cc3ccccc3cc21.CC1(C)c2ccc(N(c3ccc4ccccc4c3-c3ccc4ccccc4c3)c3cccc4oc5ccccc5c34)cc2-c2cc3ccccc3cc21
InChIInChI=1S/C57H40N2.2C51H35NO.C51H35NS/c1-57(2)50-31-30-44(36-49(50)48-34-40-18-8-9-19-41(40)35-51(48)57)58(54-26-14-24-47-46-23-12-13-25-52(46)59(56(47)54)43-20-4-3-5-21-43)53-32-29-38-16-10-11-22-45(38)55(53)42-28-27-37-15-6-7-17-39(37)33-42;1-51(2)44-26-25-38(31-43(44)42-29-35-15-5-6-16-36(35)30-45(42)51)52(47-20-11-19-41-40-18-9-10-21-48(40)53-50(41)47)46-27-24-33-13-7-8-17-39(33)49(46)37-23-22-32-12-3-4-14-34(32)28-37;1-51(2)43-26-25-38(31-42(43)41-29-35-15-5-6-16-36(35)30-44(41)51)52(45-19-11-21-48-50(45)40-18-9-10-20-47(40)53-48)46-27-24-33-13-7-8-17-39(33)49(46)37-23-22-32-12-3-4-14-34(32)28-37;1-51(2)44-26-25-38(31-43(44)42-29-35-15-5-6-16-36(35)30-45(42)51)52(47-20-11-19-41-40-18-9-10-21-48(40)53-50(41)47)46-27-24-33-13-7-8-17-39(33)49(46)37-23-22-32-12-3-4-14-34(32)28-37/h3-36H,1-2H3;3*3-31H,1-2H3
InChIKeySJQCGSWLVPVYDD-UHFFFAOYSA-N
XLogP59.62
TPSA44.17 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds17
Heavy Atoms218
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002802.57
LogP ≤ 559.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzothiophen-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)-9-phenylcarbazol-1-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzothiophen-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)-9-phenylcarbazol-1-amine?
The IUPAC name of N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzothiophen-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)-9-phenylcarbazol-1-amine (CID 165068649) is N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzothiophen-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)-9-phenylcarbazol-1-amine.
What is the SMILES notation for N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzothiophen-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)-9-phenylcarbazol-1-amine?
The canonical SMILES for N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzothiophen-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)-9-phenylcarbazol-1-amine is CC1(C)c2ccc(N(c3ccc4ccccc4c3-c3ccc4ccccc4c3)c3cccc4c3oc3ccccc34)cc2-c2cc3ccccc3cc21.CC1(C)c2ccc(N(c3ccc4ccccc4c3-c3ccc4ccccc4c3)c3cccc4c3sc3ccccc34)cc2-c2cc3ccccc3cc21.CC1(C)c2ccc(N(c3ccc4ccccc4c3-c3ccc4ccccc4c3)c3cccc4c5ccccc5n(-c5ccccc5)c34)cc2-c2cc3ccccc3cc21.CC1(C)c2ccc(N(c3ccc4ccccc4c3-c3ccc4ccccc4c3)c3cccc4oc5ccccc5c34)cc2-c2cc3ccccc3cc21.
What is the InChIKey of N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzothiophen-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)-9-phenylcarbazol-1-amine?
The InChIKey is SJQCGSWLVPVYDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H40N2.2C51H35NO.C51H35NS/c1-57(2)50-31-30-44(36-49(50)48-34-40-18-8-9-19-41(40)35-51(48)57)58(54-26-14-24-47-46-23-12-13-25-52(46)59(56(47)54)43-20-4-3-5-21-43)53-32-29-38-16-10-11-22-45(38)55(53)42-28-27-37-15-6-7-17-39(37)33-42;1-51(2)44-26-25-38(31-43(44)42-29-35-15-5-6-16-36(35)30-45(42)51)52(47-20-11-19-41-40-18-9-10-21-48(40)53-50(41)47)46-27-24-33-13-7-8-17-39(33)49(46)37-23-22-32-12-3-4-14-34(32)28-37;1-51(2)43-26-25-38(31-42(43)41-29-35-15-5-6-16-36(35)30-44(41)51)52(45-19-11-21-48-50(45)40-18-9-10-20-47(40)53-48)46-27-24-33-13-7-8-17-39(33)49(46)37-23-22-32-12-3-4-14-34(32)28-37;1-51(2)44-26-25-38(31-43(44)42-29-35-15-5-6-16-36(35)30-45(42)51)52(47-20-11-19-41-40-18-9-10-21-48(40)53-50(41)47)46-27-24-33-13-7-8-17-39(33)49(46)37-23-22-32-12-3-4-14-34(32)28-37/h3-36H,1-2H3;3*3-31H,1-2H3.
What are the key properties of N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzothiophen-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)-9-phenylcarbazol-1-amine?
N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzothiophen-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)-9-phenylcarbazol-1-amine has a molecular weight of 2802.57 g/mol, XLogP of 59.62, 17 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-1-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)dibenzothiophen-4-amine;N-(11,11-dimethylbenzo[b]fluoren-3-yl)-N-(1-naphthalen-2-ylnaphthalen-2-yl)-9-phenylcarbazol-1-amine is sourced from PubChem (CID 165068649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).