N,9-dinaphthalen-2-yl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-1-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;9-naphthalen-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine

C232H146N8O4 — CID 165032173

IUPACN,9-dinaphthalen-2-yl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-1-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;9-naphthalen-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine
SMILESc1ccc(-n2c3ccccc3c3cc(N(c4ccc5ccccc5c4)c4ccc5c6c(cccc46)C4(c6ccccc6Oc6ccccc64)c4ccccc4-5)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(N(c4cccc5ccccc45)c4ccc5c6c(cccc46)C4(c6ccccc6Oc6ccccc64)c4ccccc4-5)ccc32)cc1.c1ccc(N(c2ccc3c(c2)c2ccccc2n3-c2ccc3ccccc3c2)c2ccc3c4c(cccc24)C2(c4ccccc4Oc4ccccc42)c2ccccc2-3)cc1.c1ccc2c(c1)Oc1ccccc1C21c2ccccc2-c2ccc(N(c3ccc4ccccc4c3)c3ccc4c(c3)c3ccccc3n4-c3ccc4ccccc4c3)c3cccc1c23
InChIInChI=1S/C61H38N2O.3C57H36N2O/c1-3-16-41-36-43(30-28-39(41)14-1)62(45-32-34-57-50(38-45)47-19-6-10-25-55(47)63(57)44-31-29-40-15-2-4-17-42(40)37-44)56-35-33-48-46-18-5-7-21-51(46)61(54-24-13-20-49(56)60(48)54)52-22-8-11-26-58(52)64-59-27-12-9-23-53(59)61;1-2-18-38(19-3-1)58-51-28-11-7-22-42(51)45-36-39(32-34-53(45)58)59(50-29-14-17-37-16-4-5-20-40(37)50)52-35-33-43-41-21-6-8-24-46(41)57(49-27-15-23-44(52)56(43)49)47-25-9-12-30-54(47)60-55-31-13-10-26-48(55)57;1-2-17-39(18-3-1)59-51-26-11-7-20-43(51)46-36-41(31-33-53(46)59)58(40-30-29-37-15-4-5-16-38(37)35-40)52-34-32-44-42-19-6-8-22-47(42)57(50-25-14-21-45(52)56(44)50)48-23-9-12-27-54(48)60-55-28-13-10-24-49(55)57;1-2-17-39(18-3-1)58(41-31-33-53-46(36-41)43-20-7-11-26-51(43)59(53)40-30-29-37-15-4-5-16-38(37)35-40)52-34-32-44-42-19-6-8-22-47(42)57(50-25-14-21-45(52)56(44)50)48-23-9-12-27-54(48)60-55-28-13-10-24-49(55)57/h1-38H;3*1-36H
InChIKeyMVGQFCYWECGQAG-UHFFFAOYSA-N
MW3109.77 g/mol
LogP61.27
Rot. Bonds16

About N,9-dinaphthalen-2-yl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-1-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;9-naphthalen-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine

N,9-dinaphthalen-2-yl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-1-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;9-naphthalen-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine (PubChem CID 165032173) has the molecular formula C232H146N8O4 and a molecular weight of 3109.77 g/mol. Its IUPAC name is N,9-dinaphthalen-2-yl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-1-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;9-naphthalen-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine.

Molecular Properties

Compound NameN,9-dinaphthalen-2-yl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-1-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;9-naphthalen-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine
PubChem CID165032173
Molecular FormulaC232H146N8O4
Molecular Weight3109.77 g/mol
Exact Mass3107.15
IUPAC NameN,9-dinaphthalen-2-yl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-1-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;9-naphthalen-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine
SMILESc1ccc(-n2c3ccccc3c3cc(N(c4ccc5ccccc5c4)c4ccc5c6c(cccc46)C4(c6ccccc6Oc6ccccc64)c4ccccc4-5)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(N(c4cccc5ccccc45)c4ccc5c6c(cccc46)C4(c6ccccc6Oc6ccccc64)c4ccccc4-5)ccc32)cc1.c1ccc(N(c2ccc3c(c2)c2ccccc2n3-c2ccc3ccccc3c2)c2ccc3c4c(cccc24)C2(c4ccccc4Oc4ccccc42)c2ccccc2-3)cc1.c1ccc2c(c1)Oc1ccccc1C21c2ccccc2-c2ccc(N(c3ccc4ccccc4c3)c3ccc4c(c3)c3ccccc3n4-c3ccc4ccccc4c3)c3cccc1c23
InChIInChI=1S/C61H38N2O.3C57H36N2O/c1-3-16-41-36-43(30-28-39(41)14-1)62(45-32-34-57-50(38-45)47-19-6-10-25-55(47)63(57)44-31-29-40-15-2-4-17-42(40)37-44)56-35-33-48-46-18-5-7-21-51(46)61(54-24-13-20-49(56)60(48)54)52-22-8-11-26-58(52)64-59-27-12-9-23-53(59)61;1-2-18-38(19-3-1)58-51-28-11-7-22-42(51)45-36-39(32-34-53(45)58)59(50-29-14-17-37-16-4-5-20-40(37)50)52-35-33-43-41-21-6-8-24-46(41)57(49-27-15-23-44(52)56(43)49)47-25-9-12-30-54(47)60-55-31-13-10-26-48(55)57;1-2-17-39(18-3-1)59-51-26-11-7-20-43(51)46-36-41(31-33-53(46)59)58(40-30-29-37-15-4-5-16-38(37)35-40)52-34-32-44-42-19-6-8-22-47(42)57(50-25-14-21-45(52)56(44)50)48-23-9-12-27-54(48)60-55-28-13-10-24-49(55)57;1-2-17-39(18-3-1)58(41-31-33-53-46(36-41)43-20-7-11-26-51(43)59(53)40-30-29-37-15-4-5-16-38(37)35-40)52-34-32-44-42-19-6-8-22-47(42)57(50-25-14-21-45(52)56(44)50)48-23-9-12-27-54(48)60-55-28-13-10-24-49(55)57/h1-38H;3*1-36H
InChIKeyMVGQFCYWECGQAG-UHFFFAOYSA-N
XLogP61.27
TPSA69.60 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds16
Heavy Atoms244
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003109.77
LogP ≤ 561.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze N,9-dinaphthalen-2-yl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-1-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;9-naphthalen-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N,9-dinaphthalen-2-yl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-1-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;9-naphthalen-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine?
The IUPAC name of N,9-dinaphthalen-2-yl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-1-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;9-naphthalen-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine (CID 165032173) is N,9-dinaphthalen-2-yl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-1-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;9-naphthalen-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine.
What is the SMILES notation for N,9-dinaphthalen-2-yl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-1-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;9-naphthalen-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine?
The canonical SMILES for N,9-dinaphthalen-2-yl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-1-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;9-naphthalen-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine is c1ccc(-n2c3ccccc3c3cc(N(c4ccc5ccccc5c4)c4ccc5c6c(cccc46)C4(c6ccccc6Oc6ccccc64)c4ccccc4-5)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(N(c4cccc5ccccc45)c4ccc5c6c(cccc46)C4(c6ccccc6Oc6ccccc64)c4ccccc4-5)ccc32)cc1.c1ccc(N(c2ccc3c(c2)c2ccccc2n3-c2ccc3ccccc3c2)c2ccc3c4c(cccc24)C2(c4ccccc4Oc4ccccc42)c2ccccc2-3)cc1.c1ccc2c(c1)Oc1ccccc1C21c2ccccc2-c2ccc(N(c3ccc4ccccc4c3)c3ccc4c(c3)c3ccccc3n4-c3ccc4ccccc4c3)c3cccc1c23.
What is the InChIKey of N,9-dinaphthalen-2-yl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-1-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;9-naphthalen-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine?
The InChIKey is MVGQFCYWECGQAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H38N2O.3C57H36N2O/c1-3-16-41-36-43(30-28-39(41)14-1)62(45-32-34-57-50(38-45)47-19-6-10-25-55(47)63(57)44-31-29-40-15-2-4-17-42(40)37-44)56-35-33-48-46-18-5-7-21-51(46)61(54-24-13-20-49(56)60(48)54)52-22-8-11-26-58(52)64-59-27-12-9-23-53(59)61;1-2-18-38(19-3-1)58-51-28-11-7-22-42(51)45-36-39(32-34-53(45)58)59(50-29-14-17-37-16-4-5-20-40(37)50)52-35-33-43-41-21-6-8-24-46(41)57(49-27-15-23-44(52)56(43)49)47-25-9-12-30-54(47)60-55-31-13-10-26-48(55)57;1-2-17-39(18-3-1)59-51-26-11-7-20-43(51)46-36-41(31-33-53(46)59)58(40-30-29-37-15-4-5-16-38(37)35-40)52-34-32-44-42-19-6-8-22-47(42)57(50-25-14-21-45(52)56(44)50)48-23-9-12-27-54(48)60-55-28-13-10-24-49(55)57;1-2-17-39(18-3-1)58(41-31-33-53-46(36-41)43-20-7-11-26-51(43)59(53)40-30-29-37-15-4-5-16-38(37)35-40)52-34-32-44-42-19-6-8-22-47(42)57(50-25-14-21-45(52)56(44)50)48-23-9-12-27-54(48)60-55-28-13-10-24-49(55)57/h1-38H;3*1-36H.
What are the key properties of N,9-dinaphthalen-2-yl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-1-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;9-naphthalen-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine?
N,9-dinaphthalen-2-yl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-1-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;9-naphthalen-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine has a molecular weight of 3109.77 g/mol, XLogP of 61.27, 16 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for N,9-dinaphthalen-2-yl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-1-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;N-naphthalen-2-yl-9-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine;9-naphthalen-2-yl-N-phenyl-N-spiro[benzo[a]phenalene-7,9'-xanthene]-3-ylcarbazol-3-amine is sourced from PubChem (CID 165032173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).