N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-1-yldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine

C154H114N4O4 — CID 157179912

IUPACN-(9,9-dimethylfluoren-2-yl)-N-naphthalen-1-yldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc4oc5ccccc5c4c3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4oc5ccccc5c4c3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc4oc5ccccc5c4c3)c3cccc4ccccc34)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc4oc5ccccc5c4c3)cc21
InChIInChI=1S/C45H33NO.C39H29NO.C37H27NO.C33H25NO/c1-45(2)41-14-8-6-12-37(41)38-26-24-36(29-42(38)45)46(35-25-27-44-40(28-35)39-13-7-9-15-43(39)47-44)34-22-20-33(21-23-34)32-18-16-31(17-19-32)30-10-4-3-5-11-30;1-39(2)35-14-8-6-12-31(35)32-22-20-30(25-36(32)39)40(28-18-16-27(17-19-28)26-10-4-3-5-11-26)29-21-23-38-34(24-29)33-13-7-9-15-37(33)41-38;1-37(2)32-15-7-5-13-28(32)29-20-18-26(23-33(29)37)38(34-16-9-11-24-10-3-4-12-27(24)34)25-19-21-36-31(22-25)30-14-6-8-17-35(30)39-36;1-33(2)29-14-8-6-12-25(29)26-18-16-24(21-30(26)33)34(22-10-4-3-5-11-22)23-17-19-32-28(20-23)27-13-7-9-15-31(27)35-32/h3-29H,1-2H3;3-25H,1-2H3;3-23H,1-2H3;3-21H,1-2H3
InChIKeyAOLJAVGWTVHGMZ-UHFFFAOYSA-N
MW2084.63 g/mol
LogP43.60
Rot. Bonds15

About N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-1-yldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine

N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-1-yldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine (PubChem CID 157179912) has the molecular formula C154H114N4O4 and a molecular weight of 2084.63 g/mol. Its IUPAC name is N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-1-yldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine.

Molecular Properties

Compound NameN-(9,9-dimethylfluoren-2-yl)-N-naphthalen-1-yldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine
PubChem CID157179912
Molecular FormulaC154H114N4O4
Molecular Weight2084.63 g/mol
Exact Mass2082.88
IUPAC NameN-(9,9-dimethylfluoren-2-yl)-N-naphthalen-1-yldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc4oc5ccccc5c4c3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4oc5ccccc5c4c3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc4oc5ccccc5c4c3)c3cccc4ccccc34)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc4oc5ccccc5c4c3)cc21
InChIInChI=1S/C45H33NO.C39H29NO.C37H27NO.C33H25NO/c1-45(2)41-14-8-6-12-37(41)38-26-24-36(29-42(38)45)46(35-25-27-44-40(28-35)39-13-7-9-15-43(39)47-44)34-22-20-33(21-23-34)32-18-16-31(17-19-32)30-10-4-3-5-11-30;1-39(2)35-14-8-6-12-31(35)32-22-20-30(25-36(32)39)40(28-18-16-27(17-19-28)26-10-4-3-5-11-26)29-21-23-38-34(24-29)33-13-7-9-15-37(33)41-38;1-37(2)32-15-7-5-13-28(32)29-20-18-26(23-33(29)37)38(34-16-9-11-24-10-3-4-12-27(24)34)25-19-21-36-31(22-25)30-14-6-8-17-35(30)39-36;1-33(2)29-14-8-6-12-25(29)26-18-16-24(21-30(26)33)34(22-10-4-3-5-11-22)23-17-19-32-28(20-23)27-13-7-9-15-31(27)35-32/h3-29H,1-2H3;3-25H,1-2H3;3-23H,1-2H3;3-21H,1-2H3
InChIKeyAOLJAVGWTVHGMZ-UHFFFAOYSA-N
XLogP43.60
TPSA65.52 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds15
Heavy Atoms162
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002084.63
LogP ≤ 543.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-1-yldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-1-yldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine?
The IUPAC name of N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-1-yldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine (CID 157179912) is N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-1-yldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine.
What is the SMILES notation for N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-1-yldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine?
The canonical SMILES for N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-1-yldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc4oc5ccccc5c4c3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4oc5ccccc5c4c3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc4oc5ccccc5c4c3)c3cccc4ccccc34)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc4oc5ccccc5c4c3)cc21.
What is the InChIKey of N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-1-yldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine?
The InChIKey is AOLJAVGWTVHGMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H33NO.C39H29NO.C37H27NO.C33H25NO/c1-45(2)41-14-8-6-12-37(41)38-26-24-36(29-42(38)45)46(35-25-27-44-40(28-35)39-13-7-9-15-43(39)47-44)34-22-20-33(21-23-34)32-18-16-31(17-19-32)30-10-4-3-5-11-30;1-39(2)35-14-8-6-12-31(35)32-22-20-30(25-36(32)39)40(28-18-16-27(17-19-28)26-10-4-3-5-11-26)29-21-23-38-34(24-29)33-13-7-9-15-37(33)41-38;1-37(2)32-15-7-5-13-28(32)29-20-18-26(23-33(29)37)38(34-16-9-11-24-10-3-4-12-27(24)34)25-19-21-36-31(22-25)30-14-6-8-17-35(30)39-36;1-33(2)29-14-8-6-12-25(29)26-18-16-24(21-30(26)33)34(22-10-4-3-5-11-22)23-17-19-32-28(20-23)27-13-7-9-15-31(27)35-32/h3-29H,1-2H3;3-25H,1-2H3;3-23H,1-2H3;3-21H,1-2H3.
What are the key properties of N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-1-yldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine?
N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-1-yldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine has a molecular weight of 2084.63 g/mol, XLogP of 43.60, 15 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-1-yldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-phenyldibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-2-amine is sourced from PubChem (CID 157179912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).