2-[[6-(dinaphthalen-2-ylamino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-methylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-naphthalen-2-ylanilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione

C187H125N5O10 — CID 161266677

IUPAC2-[[6-(dinaphthalen-2-ylamino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-methylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-naphthalen-2-ylanilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione
SMILESCc1ccc(N(c2ccc(-c3ccccc3)cc2)c2ccc3cc(C=C4C(=O)c5ccccc5C4=O)ccc3c2)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc3cc(C=C4C(=O)c5ccccc5C4=O)ccc3c2)cc1.O=C1C(=Cc2ccc3cc(N(c4ccc5ccccc5c4)c4ccc5ccccc5c4)ccc3c2)C(=O)c2ccccc21.O=C1C(=Cc2ccc3cc(N(c4ccccc4)c4ccc(-c5ccccc5)cc4)ccc3c2)C(=O)c2ccccc21.O=C1C(=Cc2ccc3cc(N(c4ccccc4)c4ccc5ccccc5c4)ccc3c2)C(=O)c2ccccc21
InChIInChI=1S/C40H25NO2.C39H27NO2.C38H25NO2.C36H23NO2.C34H25NO2/c42-39-36-11-5-6-12-37(36)40(43)38(39)22-26-13-14-32-25-35(20-17-31(32)21-26)41(33-18-15-27-7-1-3-9-29(27)23-33)34-19-16-28-8-2-4-10-30(28)24-34;1-26-11-18-32(19-12-26)40(33-20-15-29(16-21-33)28-7-3-2-4-8-28)34-22-17-30-23-27(13-14-31(30)25-34)24-37-38(41)35-9-5-6-10-36(35)39(37)42;40-37-34-13-7-8-14-35(34)38(41)36(37)24-26-15-16-30-25-33(22-19-29(30)23-26)39(31-11-5-2-6-12-31)32-20-17-28(18-21-32)27-9-3-1-4-10-27;38-35-32-12-6-7-13-33(32)36(39)34(35)21-24-14-15-28-23-31(19-17-27(28)20-24)37(29-10-2-1-3-11-29)30-18-16-25-8-4-5-9-26(25)22-30;1-22-7-14-27(15-8-22)35(28-16-9-23(2)10-17-28)29-18-13-25-19-24(11-12-26(25)21-29)20-32-33(36)30-5-3-4-6-31(30)34(32)37/h1-25H;2-25H,1H3;1-25H;1-23H;3-21H,1-2H3
InChIKeyVDGYIGXSQLTLNZ-UHFFFAOYSA-N
MW2602.08 g/mol
LogP46.58
Rot. Bonds22

About 2-[[6-(dinaphthalen-2-ylamino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-methylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-naphthalen-2-ylanilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione

2-[[6-(dinaphthalen-2-ylamino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-methylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-naphthalen-2-ylanilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione (PubChem CID 161266677) has the molecular formula C187H125N5O10 and a molecular weight of 2602.08 g/mol. Its IUPAC name is 2-[[6-(dinaphthalen-2-ylamino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-methylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-naphthalen-2-ylanilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione.

Molecular Properties

Compound Name2-[[6-(dinaphthalen-2-ylamino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-methylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-naphthalen-2-ylanilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione
PubChem CID161266677
Molecular FormulaC187H125N5O10
Molecular Weight2602.08 g/mol
Exact Mass2599.94
IUPAC Name2-[[6-(dinaphthalen-2-ylamino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-methylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-naphthalen-2-ylanilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione
SMILESCc1ccc(N(c2ccc(-c3ccccc3)cc2)c2ccc3cc(C=C4C(=O)c5ccccc5C4=O)ccc3c2)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc3cc(C=C4C(=O)c5ccccc5C4=O)ccc3c2)cc1.O=C1C(=Cc2ccc3cc(N(c4ccc5ccccc5c4)c4ccc5ccccc5c4)ccc3c2)C(=O)c2ccccc21.O=C1C(=Cc2ccc3cc(N(c4ccccc4)c4ccc(-c5ccccc5)cc4)ccc3c2)C(=O)c2ccccc21.O=C1C(=Cc2ccc3cc(N(c4ccccc4)c4ccc5ccccc5c4)ccc3c2)C(=O)c2ccccc21
InChIInChI=1S/C40H25NO2.C39H27NO2.C38H25NO2.C36H23NO2.C34H25NO2/c42-39-36-11-5-6-12-37(36)40(43)38(39)22-26-13-14-32-25-35(20-17-31(32)21-26)41(33-18-15-27-7-1-3-9-29(27)23-33)34-19-16-28-8-2-4-10-30(28)24-34;1-26-11-18-32(19-12-26)40(33-20-15-29(16-21-33)28-7-3-2-4-8-28)34-22-17-30-23-27(13-14-31(30)25-34)24-37-38(41)35-9-5-6-10-36(35)39(37)42;40-37-34-13-7-8-14-35(34)38(41)36(37)24-26-15-16-30-25-33(22-19-29(30)23-26)39(31-11-5-2-6-12-31)32-20-17-28(18-21-32)27-9-3-1-4-10-27;38-35-32-12-6-7-13-33(32)36(39)34(35)21-24-14-15-28-23-31(19-17-27(28)20-24)37(29-10-2-1-3-11-29)30-18-16-25-8-4-5-9-26(25)22-30;1-22-7-14-27(15-8-22)35(28-16-9-23(2)10-17-28)29-18-13-25-19-24(11-12-26(25)21-29)20-32-33(36)30-5-3-4-6-31(30)34(32)37/h1-25H;2-25H,1H3;1-25H;1-23H;3-21H,1-2H3
InChIKeyVDGYIGXSQLTLNZ-UHFFFAOYSA-N
XLogP46.58
TPSA186.90 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds22
Heavy Atoms202
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002602.08
LogP ≤ 546.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'ene_five_one_A(55)', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_4', 'substructure': 'N/A'}

Analyze 2-[[6-(dinaphthalen-2-ylamino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-methylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-naphthalen-2-ylanilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-[[6-(dinaphthalen-2-ylamino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-methylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-naphthalen-2-ylanilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione?
The IUPAC name of 2-[[6-(dinaphthalen-2-ylamino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-methylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-naphthalen-2-ylanilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione (CID 161266677) is 2-[[6-(dinaphthalen-2-ylamino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-methylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-naphthalen-2-ylanilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione.
What is the SMILES notation for 2-[[6-(dinaphthalen-2-ylamino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-methylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-naphthalen-2-ylanilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione?
The canonical SMILES for 2-[[6-(dinaphthalen-2-ylamino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-methylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-naphthalen-2-ylanilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione is Cc1ccc(N(c2ccc(-c3ccccc3)cc2)c2ccc3cc(C=C4C(=O)c5ccccc5C4=O)ccc3c2)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc3cc(C=C4C(=O)c5ccccc5C4=O)ccc3c2)cc1.O=C1C(=Cc2ccc3cc(N(c4ccc5ccccc5c4)c4ccc5ccccc5c4)ccc3c2)C(=O)c2ccccc21.O=C1C(=Cc2ccc3cc(N(c4ccccc4)c4ccc(-c5ccccc5)cc4)ccc3c2)C(=O)c2ccccc21.O=C1C(=Cc2ccc3cc(N(c4ccccc4)c4ccc5ccccc5c4)ccc3c2)C(=O)c2ccccc21.
What is the InChIKey of 2-[[6-(dinaphthalen-2-ylamino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-methylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-naphthalen-2-ylanilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione?
The InChIKey is VDGYIGXSQLTLNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H25NO2.C39H27NO2.C38H25NO2.C36H23NO2.C34H25NO2/c42-39-36-11-5-6-12-37(36)40(43)38(39)22-26-13-14-32-25-35(20-17-31(32)21-26)41(33-18-15-27-7-1-3-9-29(27)23-33)34-19-16-28-8-2-4-10-30(28)24-34;1-26-11-18-32(19-12-26)40(33-20-15-29(16-21-33)28-7-3-2-4-8-28)34-22-17-30-23-27(13-14-31(30)25-34)24-37-38(41)35-9-5-6-10-36(35)39(37)42;40-37-34-13-7-8-14-35(34)38(41)36(37)24-26-15-16-30-25-33(22-19-29(30)23-26)39(31-11-5-2-6-12-31)32-20-17-28(18-21-32)27-9-3-1-4-10-27;38-35-32-12-6-7-13-33(32)36(39)34(35)21-24-14-15-28-23-31(19-17-27(28)20-24)37(29-10-2-1-3-11-29)30-18-16-25-8-4-5-9-26(25)22-30;1-22-7-14-27(15-8-22)35(28-16-9-23(2)10-17-28)29-18-13-25-19-24(11-12-26(25)21-29)20-32-33(36)30-5-3-4-6-31(30)34(32)37/h1-25H;2-25H,1H3;1-25H;1-23H;3-21H,1-2H3.
What are the key properties of 2-[[6-(dinaphthalen-2-ylamino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-methylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-naphthalen-2-ylanilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione?
2-[[6-(dinaphthalen-2-ylamino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-methylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-naphthalen-2-ylanilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione has a molecular weight of 2602.08 g/mol, XLogP of 46.58, 22 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-(dinaphthalen-2-ylamino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-methylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(4-methyl-N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-naphthalen-2-ylanilino)naphthalen-2-yl]methylidene]indene-1,3-dione;2-[[6-(N-(4-phenylphenyl)anilino)naphthalen-2-yl]methylidene]indene-1,3-dione is sourced from PubChem (CID 161266677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).