9,9-dimethyl-N-[4-(1-methylpyrrol-3-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-pyridin-2-ylphenyl)fluoren-2-amine;N-(4-indol-1-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine

C153H115N9 — CID 158904287

IUPAC9,9-dimethyl-N-[4-(1-methylpyrrol-3-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-pyridin-2-ylphenyl)fluoren-2-amine;N-(4-indol-1-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3ccc(-c4ccccn4)cc3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3ccc(-n4ccc5ccccc54)cc3)cc21.Cn1ccc(-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc2)c1
InChIInChI=1S/C53H39N3.C50H39N3.C50H37N3/c1-53(2)48-17-9-7-15-44(48)45-30-29-43(35-49(45)53)55(42-27-25-39(26-28-42)54-33-32-37-12-6-10-18-50(37)54)41-23-20-36(21-24-41)38-22-31-52-47(34-38)46-16-8-11-19-51(46)56(52)40-13-4-3-5-14-40;1-50(2)46-15-9-7-13-42(46)43-27-26-41(32-47(43)50)52(40-24-19-35(20-25-40)37-29-30-51(3)33-37)39-22-17-34(18-23-39)36-21-28-49-45(31-36)44-14-8-10-16-48(44)53(49)38-11-5-4-6-12-38;1-50(2)45-16-8-6-14-41(45)42-29-28-40(33-46(42)50)52(39-26-21-35(22-27-39)47-17-10-11-31-51-47)38-24-19-34(20-25-38)36-23-30-49-44(32-36)43-15-7-9-18-48(43)53(49)37-12-4-3-5-13-37/h3-35H,1-2H3;4-33H,1-3H3;3-33H,1-2H3
InChIKeyJFVQBPGFROQBFL-UHFFFAOYSA-N
MW2079.67 g/mol
LogP40.69
Rot. Bonds18

About 9,9-dimethyl-N-[4-(1-methylpyrrol-3-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-pyridin-2-ylphenyl)fluoren-2-amine;N-(4-indol-1-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine

9,9-dimethyl-N-[4-(1-methylpyrrol-3-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-pyridin-2-ylphenyl)fluoren-2-amine;N-(4-indol-1-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine (PubChem CID 158904287) has the molecular formula C153H115N9 and a molecular weight of 2079.67 g/mol. Its IUPAC name is 9,9-dimethyl-N-[4-(1-methylpyrrol-3-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-pyridin-2-ylphenyl)fluoren-2-amine;N-(4-indol-1-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine.

Molecular Properties

Compound Name9,9-dimethyl-N-[4-(1-methylpyrrol-3-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-pyridin-2-ylphenyl)fluoren-2-amine;N-(4-indol-1-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine
PubChem CID158904287
Molecular FormulaC153H115N9
Molecular Weight2079.67 g/mol
Exact Mass2077.93
IUPAC Name9,9-dimethyl-N-[4-(1-methylpyrrol-3-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-pyridin-2-ylphenyl)fluoren-2-amine;N-(4-indol-1-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3ccc(-c4ccccn4)cc3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3ccc(-n4ccc5ccccc54)cc3)cc21.Cn1ccc(-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc2)c1
InChIInChI=1S/C53H39N3.C50H39N3.C50H37N3/c1-53(2)48-17-9-7-15-44(48)45-30-29-43(35-49(45)53)55(42-27-25-39(26-28-42)54-33-32-37-12-6-10-18-50(37)54)41-23-20-36(21-24-41)38-22-31-52-47(34-38)46-16-8-11-19-51(46)56(52)40-13-4-3-5-14-40;1-50(2)46-15-9-7-13-42(46)43-27-26-41(32-47(43)50)52(40-24-19-35(20-25-40)37-29-30-51(3)33-37)39-22-17-34(18-23-39)36-21-28-49-45(31-36)44-14-8-10-16-48(44)53(49)38-11-5-4-6-12-38;1-50(2)45-16-8-6-14-41(45)42-29-28-40(33-46(42)50)52(39-26-21-35(22-27-39)47-17-10-11-31-51-47)38-24-19-34(20-25-38)36-23-30-49-44(32-36)43-15-7-9-18-48(43)53(49)37-12-4-3-5-13-37/h3-35H,1-2H3;4-33H,1-3H3;3-33H,1-2H3
InChIKeyJFVQBPGFROQBFL-UHFFFAOYSA-N
XLogP40.69
TPSA47.26 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds18
Heavy Atoms162
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002079.67
LogP ≤ 540.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 9,9-dimethyl-N-[4-(1-methylpyrrol-3-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-pyridin-2-ylphenyl)fluoren-2-amine;N-(4-indol-1-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-N-[4-(1-methylpyrrol-3-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-pyridin-2-ylphenyl)fluoren-2-amine;N-(4-indol-1-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine?
The IUPAC name of 9,9-dimethyl-N-[4-(1-methylpyrrol-3-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-pyridin-2-ylphenyl)fluoren-2-amine;N-(4-indol-1-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine (CID 158904287) is 9,9-dimethyl-N-[4-(1-methylpyrrol-3-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-pyridin-2-ylphenyl)fluoren-2-amine;N-(4-indol-1-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine.
What is the SMILES notation for 9,9-dimethyl-N-[4-(1-methylpyrrol-3-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-pyridin-2-ylphenyl)fluoren-2-amine;N-(4-indol-1-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine?
The canonical SMILES for 9,9-dimethyl-N-[4-(1-methylpyrrol-3-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-pyridin-2-ylphenyl)fluoren-2-amine;N-(4-indol-1-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3ccc(-c4ccccn4)cc3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3ccc(-n4ccc5ccccc54)cc3)cc21.Cn1ccc(-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc2)c1.
What is the InChIKey of 9,9-dimethyl-N-[4-(1-methylpyrrol-3-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-pyridin-2-ylphenyl)fluoren-2-amine;N-(4-indol-1-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine?
The InChIKey is JFVQBPGFROQBFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H39N3.C50H39N3.C50H37N3/c1-53(2)48-17-9-7-15-44(48)45-30-29-43(35-49(45)53)55(42-27-25-39(26-28-42)54-33-32-37-12-6-10-18-50(37)54)41-23-20-36(21-24-41)38-22-31-52-47(34-38)46-16-8-11-19-51(46)56(52)40-13-4-3-5-14-40;1-50(2)46-15-9-7-13-42(46)43-27-26-41(32-47(43)50)52(40-24-19-35(20-25-40)37-29-30-51(3)33-37)39-22-17-34(18-23-39)36-21-28-49-45(31-36)44-14-8-10-16-48(44)53(49)38-11-5-4-6-12-38;1-50(2)45-16-8-6-14-41(45)42-29-28-40(33-46(42)50)52(39-26-21-35(22-27-39)47-17-10-11-31-51-47)38-24-19-34(20-25-38)36-23-30-49-44(32-36)43-15-7-9-18-48(43)53(49)37-12-4-3-5-13-37/h3-35H,1-2H3;4-33H,1-3H3;3-33H,1-2H3.
What are the key properties of 9,9-dimethyl-N-[4-(1-methylpyrrol-3-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-pyridin-2-ylphenyl)fluoren-2-amine;N-(4-indol-1-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine?
9,9-dimethyl-N-[4-(1-methylpyrrol-3-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-pyridin-2-ylphenyl)fluoren-2-amine;N-(4-indol-1-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine has a molecular weight of 2079.67 g/mol, XLogP of 40.69, 18 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-N-[4-(1-methylpyrrol-3-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-pyridin-2-ylphenyl)fluoren-2-amine;N-(4-indol-1-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine is sourced from PubChem (CID 158904287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).