11,11-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-1-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-2-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenanthren-9-ylbenzo[b]fluoren-3-amine

C203H146N4 — CID 165014887

IUPAC11,11-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-1-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-2-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenanthren-9-ylbenzo[b]fluoren-3-amine
SMILESCC1(C)c2ccc(N(c3ccc4ccccc4c3)c3ccc4ccccc4c3-c3cccc4ccccc34)cc2-c2cc3ccccc3cc21.CC1(C)c2ccc(N(c3ccc4ccccc4c3-c3cccc4ccccc34)c3cc4ccccc4c4ccccc34)cc2-c2cc3ccccc3cc21.CC1(C)c2ccc(N(c3ccc4ccccc4c3-c3cccc4ccccc34)c3cccc4ccccc34)cc2-c2cc3ccccc3cc21.Cc1ccc(-c2ccc(N(c3ccc4c(c3)-c3cc5ccccc5cc3C4(C)C)c3ccc4ccccc4c3-c3cccc4ccccc34)cc2)cc1
InChIInChI=1S/C53H37N.C52H39N.2C49H35N/c1-53(2)48-28-27-39(33-47(48)46-30-36-16-3-4-17-37(36)31-49(46)53)54(51-32-38-18-7-9-21-41(38)43-23-11-12-24-44(43)51)50-29-26-35-15-6-10-22-42(35)52(50)45-25-13-19-34-14-5-8-20-40(34)45;1-34-19-21-35(22-20-34)36-23-26-41(27-24-36)53(42-28-29-48-47(33-42)46-31-39-13-4-5-14-40(39)32-49(46)52(48,2)3)50-30-25-38-12-7-9-17-44(38)51(50)45-18-10-15-37-11-6-8-16-43(37)45;1-49(2)44-27-26-37(31-43(44)42-29-35-16-3-4-17-36(35)30-45(42)49)50(46-24-12-19-33-14-6-9-21-39(33)46)47-28-25-34-15-7-10-22-40(34)48(47)41-23-11-18-32-13-5-8-20-38(32)41;1-49(2)45-26-25-39(31-44(45)43-29-36-16-5-6-17-37(36)30-46(43)49)50(38-24-22-32-12-3-4-15-35(32)28-38)47-27-23-34-14-8-10-20-41(34)48(47)42-21-11-18-33-13-7-9-19-40(33)42/h3-33H,1-2H3;4-33H,1-3H3;2*3-31H,1-2H3
InChIKeyKGMSDONCLCRLHO-UHFFFAOYSA-N
MW2641.43 g/mol
LogP56.95
Rot. Bonds17

About 11,11-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-1-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-2-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenanthren-9-ylbenzo[b]fluoren-3-amine

11,11-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-1-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-2-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenanthren-9-ylbenzo[b]fluoren-3-amine (PubChem CID 165014887) has the molecular formula C203H146N4 and a molecular weight of 2641.43 g/mol. Its IUPAC name is 11,11-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-1-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-2-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenanthren-9-ylbenzo[b]fluoren-3-amine.

Molecular Properties

Compound Name11,11-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-1-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-2-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenanthren-9-ylbenzo[b]fluoren-3-amine
PubChem CID165014887
Molecular FormulaC203H146N4
Molecular Weight2641.43 g/mol
Exact Mass2639.15
IUPAC Name11,11-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-1-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-2-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenanthren-9-ylbenzo[b]fluoren-3-amine
SMILESCC1(C)c2ccc(N(c3ccc4ccccc4c3)c3ccc4ccccc4c3-c3cccc4ccccc34)cc2-c2cc3ccccc3cc21.CC1(C)c2ccc(N(c3ccc4ccccc4c3-c3cccc4ccccc34)c3cc4ccccc4c4ccccc34)cc2-c2cc3ccccc3cc21.CC1(C)c2ccc(N(c3ccc4ccccc4c3-c3cccc4ccccc34)c3cccc4ccccc34)cc2-c2cc3ccccc3cc21.Cc1ccc(-c2ccc(N(c3ccc4c(c3)-c3cc5ccccc5cc3C4(C)C)c3ccc4ccccc4c3-c3cccc4ccccc34)cc2)cc1
InChIInChI=1S/C53H37N.C52H39N.2C49H35N/c1-53(2)48-28-27-39(33-47(48)46-30-36-16-3-4-17-37(36)31-49(46)53)54(51-32-38-18-7-9-21-41(38)43-23-11-12-24-44(43)51)50-29-26-35-15-6-10-22-42(35)52(50)45-25-13-19-34-14-5-8-20-40(34)45;1-34-19-21-35(22-20-34)36-23-26-41(27-24-36)53(42-28-29-48-47(33-42)46-31-39-13-4-5-14-40(39)32-49(46)52(48,2)3)50-30-25-38-12-7-9-17-44(38)51(50)45-18-10-15-37-11-6-8-16-43(37)45;1-49(2)44-27-26-37(31-43(44)42-29-35-16-3-4-17-36(35)30-45(42)49)50(46-24-12-19-33-14-6-9-21-39(33)46)47-28-25-34-15-7-10-22-40(34)48(47)41-23-11-18-32-13-5-8-20-38(32)41;1-49(2)45-26-25-39(31-44(45)43-29-36-16-5-6-17-37(36)30-46(43)49)50(38-24-22-32-12-3-4-15-35(32)28-38)47-27-23-34-14-8-10-20-41(34)48(47)42-21-11-18-33-13-7-9-19-40(33)42/h3-33H,1-2H3;4-33H,1-3H3;2*3-31H,1-2H3
InChIKeyKGMSDONCLCRLHO-UHFFFAOYSA-N
XLogP56.95
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds17
Heavy Atoms207
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002641.43
LogP ≤ 556.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 11,11-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-1-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-2-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenanthren-9-ylbenzo[b]fluoren-3-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 11,11-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-1-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-2-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenanthren-9-ylbenzo[b]fluoren-3-amine?
The IUPAC name of 11,11-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-1-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-2-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenanthren-9-ylbenzo[b]fluoren-3-amine (CID 165014887) is 11,11-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-1-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-2-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenanthren-9-ylbenzo[b]fluoren-3-amine.
What is the SMILES notation for 11,11-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-1-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-2-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenanthren-9-ylbenzo[b]fluoren-3-amine?
The canonical SMILES for 11,11-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-1-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-2-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenanthren-9-ylbenzo[b]fluoren-3-amine is CC1(C)c2ccc(N(c3ccc4ccccc4c3)c3ccc4ccccc4c3-c3cccc4ccccc34)cc2-c2cc3ccccc3cc21.CC1(C)c2ccc(N(c3ccc4ccccc4c3-c3cccc4ccccc34)c3cc4ccccc4c4ccccc34)cc2-c2cc3ccccc3cc21.CC1(C)c2ccc(N(c3ccc4ccccc4c3-c3cccc4ccccc34)c3cccc4ccccc34)cc2-c2cc3ccccc3cc21.Cc1ccc(-c2ccc(N(c3ccc4c(c3)-c3cc5ccccc5cc3C4(C)C)c3ccc4ccccc4c3-c3cccc4ccccc34)cc2)cc1.
What is the InChIKey of 11,11-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-1-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-2-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenanthren-9-ylbenzo[b]fluoren-3-amine?
The InChIKey is KGMSDONCLCRLHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H37N.C52H39N.2C49H35N/c1-53(2)48-28-27-39(33-47(48)46-30-36-16-3-4-17-37(36)31-49(46)53)54(51-32-38-18-7-9-21-41(38)43-23-11-12-24-44(43)51)50-29-26-35-15-6-10-22-42(35)52(50)45-25-13-19-34-14-5-8-20-40(34)45;1-34-19-21-35(22-20-34)36-23-26-41(27-24-36)53(42-28-29-48-47(33-42)46-31-39-13-4-5-14-40(39)32-49(46)52(48,2)3)50-30-25-38-12-7-9-17-44(38)51(50)45-18-10-15-37-11-6-8-16-43(37)45;1-49(2)44-27-26-37(31-43(44)42-29-35-16-3-4-17-36(35)30-45(42)49)50(46-24-12-19-33-14-6-9-21-39(33)46)47-28-25-34-15-7-10-22-40(34)48(47)41-23-11-18-32-13-5-8-20-38(32)41;1-49(2)45-26-25-39(31-44(45)43-29-36-16-5-6-17-37(36)30-46(43)49)50(38-24-22-32-12-3-4-15-35(32)28-38)47-27-23-34-14-8-10-20-41(34)48(47)42-21-11-18-33-13-7-9-19-40(33)42/h3-33H,1-2H3;4-33H,1-3H3;2*3-31H,1-2H3.
What are the key properties of 11,11-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-1-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-2-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenanthren-9-ylbenzo[b]fluoren-3-amine?
11,11-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-1-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-2-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenanthren-9-ylbenzo[b]fluoren-3-amine has a molecular weight of 2641.43 g/mol, XLogP of 56.95, 17 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 11,11-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-1-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-naphthalen-2-yl-N-(1-naphthalen-1-ylnaphthalen-2-yl)benzo[b]fluoren-3-amine;11,11-dimethyl-N-(1-naphthalen-1-ylnaphthalen-2-yl)-N-phenanthren-9-ylbenzo[b]fluoren-3-amine is sourced from PubChem (CID 165014887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).