9,9-dimethyl-N-naphthalen-1-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-naphthalen-2-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-(4-phenylphenyl)-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine

C155H119N3 — CID 159836927

IUPAC9,9-dimethyl-N-naphthalen-1-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-naphthalen-2-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-(4-phenylphenyl)-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine
SMILESCC1(C)c2ccccc2-c2cccc(N(c3ccc(-c4ccccc4)cc3)c3cccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)c3)c21.CC1(C)c2ccccc2-c2cccc(N(c3cccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)c3)c3ccc4ccccc4c3)c21.CC1(C)c2ccccc2-c2cccc(N(c3cccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)c3)c3cccc4ccccc34)c21
InChIInChI=1S/C53H41N.2C51H39N/c1-53(2)48-31-16-15-29-46(48)47-30-18-32-49(52(47)53)54(44-35-33-39(34-36-44)38-19-7-3-8-20-38)45-28-17-27-43(37-45)51(42-25-13-6-14-26-42)50(40-21-9-4-10-22-40)41-23-11-5-12-24-41;1-51(2)45-32-15-14-30-43(45)44-31-18-34-47(50(44)51)52(46-33-17-26-36-19-12-13-29-42(36)46)41-28-16-27-40(35-41)49(39-24-10-5-11-25-39)48(37-20-6-3-7-21-37)38-22-8-4-9-23-38;1-51(2)46-30-15-14-28-44(46)45-29-17-31-47(50(45)51)52(43-33-32-36-18-12-13-25-40(36)34-43)42-27-16-26-41(35-42)49(39-23-10-5-11-24-39)48(37-19-6-3-7-20-37)38-21-8-4-9-22-38/h3-37H,1-2H3;2*3-35H,1-2H3
InChIKeyNOEUKQJLVXFXRX-UHFFFAOYSA-N
MW2023.68 g/mol
LogP41.38
Rot. Bonds22

About 9,9-dimethyl-N-naphthalen-1-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-naphthalen-2-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-(4-phenylphenyl)-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine

9,9-dimethyl-N-naphthalen-1-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-naphthalen-2-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-(4-phenylphenyl)-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine (PubChem CID 159836927) has the molecular formula C155H119N3 and a molecular weight of 2023.68 g/mol. Its IUPAC name is 9,9-dimethyl-N-naphthalen-1-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-naphthalen-2-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-(4-phenylphenyl)-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine.

Molecular Properties

Compound Name9,9-dimethyl-N-naphthalen-1-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-naphthalen-2-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-(4-phenylphenyl)-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine
PubChem CID159836927
Molecular FormulaC155H119N3
Molecular Weight2023.68 g/mol
Exact Mass2021.94
IUPAC Name9,9-dimethyl-N-naphthalen-1-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-naphthalen-2-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-(4-phenylphenyl)-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine
SMILESCC1(C)c2ccccc2-c2cccc(N(c3ccc(-c4ccccc4)cc3)c3cccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)c3)c21.CC1(C)c2ccccc2-c2cccc(N(c3cccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)c3)c3ccc4ccccc4c3)c21.CC1(C)c2ccccc2-c2cccc(N(c3cccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)c3)c3cccc4ccccc34)c21
InChIInChI=1S/C53H41N.2C51H39N/c1-53(2)48-31-16-15-29-46(48)47-30-18-32-49(52(47)53)54(44-35-33-39(34-36-44)38-19-7-3-8-20-38)45-28-17-27-43(37-45)51(42-25-13-6-14-26-42)50(40-21-9-4-10-22-40)41-23-11-5-12-24-41;1-51(2)45-32-15-14-30-43(45)44-31-18-34-47(50(44)51)52(46-33-17-26-36-19-12-13-29-42(36)46)41-28-16-27-40(35-41)49(39-24-10-5-11-25-39)48(37-20-6-3-7-21-37)38-22-8-4-9-23-38;1-51(2)46-30-15-14-28-44(46)45-29-17-31-47(50(45)51)52(43-33-32-36-18-12-13-25-40(36)34-43)42-27-16-26-41(35-42)49(39-23-10-5-11-24-39)48(37-19-6-3-7-20-37)38-21-8-4-9-22-38/h3-37H,1-2H3;2*3-35H,1-2H3
InChIKeyNOEUKQJLVXFXRX-UHFFFAOYSA-N
XLogP41.38
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds22
Heavy Atoms158
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002023.68
LogP ≤ 541.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 9,9-dimethyl-N-naphthalen-1-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-naphthalen-2-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-(4-phenylphenyl)-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine 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

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-N-naphthalen-1-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-naphthalen-2-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-(4-phenylphenyl)-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine?
The IUPAC name of 9,9-dimethyl-N-naphthalen-1-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-naphthalen-2-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-(4-phenylphenyl)-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine (CID 159836927) is 9,9-dimethyl-N-naphthalen-1-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-naphthalen-2-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-(4-phenylphenyl)-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine.
What is the SMILES notation for 9,9-dimethyl-N-naphthalen-1-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-naphthalen-2-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-(4-phenylphenyl)-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine?
The canonical SMILES for 9,9-dimethyl-N-naphthalen-1-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-naphthalen-2-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-(4-phenylphenyl)-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine is CC1(C)c2ccccc2-c2cccc(N(c3ccc(-c4ccccc4)cc3)c3cccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)c3)c21.CC1(C)c2ccccc2-c2cccc(N(c3cccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)c3)c3ccc4ccccc4c3)c21.CC1(C)c2ccccc2-c2cccc(N(c3cccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)c3)c3cccc4ccccc34)c21.
What is the InChIKey of 9,9-dimethyl-N-naphthalen-1-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-naphthalen-2-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-(4-phenylphenyl)-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine?
The InChIKey is NOEUKQJLVXFXRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H41N.2C51H39N/c1-53(2)48-31-16-15-29-46(48)47-30-18-32-49(52(47)53)54(44-35-33-39(34-36-44)38-19-7-3-8-20-38)45-28-17-27-43(37-45)51(42-25-13-6-14-26-42)50(40-21-9-4-10-22-40)41-23-11-5-12-24-41;1-51(2)45-32-15-14-30-43(45)44-31-18-34-47(50(44)51)52(46-33-17-26-36-19-12-13-29-42(36)46)41-28-16-27-40(35-41)49(39-24-10-5-11-25-39)48(37-20-6-3-7-21-37)38-22-8-4-9-23-38;1-51(2)46-30-15-14-28-44(46)45-29-17-31-47(50(45)51)52(43-33-32-36-18-12-13-25-40(36)34-43)42-27-16-26-41(35-42)49(39-23-10-5-11-24-39)48(37-19-6-3-7-20-37)38-21-8-4-9-22-38/h3-37H,1-2H3;2*3-35H,1-2H3.
What are the key properties of 9,9-dimethyl-N-naphthalen-1-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-naphthalen-2-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-(4-phenylphenyl)-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine?
9,9-dimethyl-N-naphthalen-1-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-naphthalen-2-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-(4-phenylphenyl)-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine has a molecular weight of 2023.68 g/mol, XLogP of 41.38, 22 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-N-naphthalen-1-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-naphthalen-2-yl-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine;9,9-dimethyl-N-(4-phenylphenyl)-N-[3-(1,2,2-triphenylethenyl)phenyl]fluoren-1-amine is sourced from PubChem (CID 159836927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).