2-(9,9-dimethylfluoren-2-yl)-7-[3-[7-(9,9-dimethylfluoren-2-yl)-2,3-dihydro-1,8-naphthyridin-2-yl]-5-[7-(9,9-dimethylfluoren-2-yl)-1,8-naphthyridin-2-yl]phenyl]-1,8-naphthyridine

C75H56N6 — CID 58771615

IUPAC2-(9,9-dimethylfluoren-2-yl)-7-[3-[7-(9,9-dimethylfluoren-2-yl)-2,3-dihydro-1,8-naphthyridin-2-yl]-5-[7-(9,9-dimethylfluoren-2-yl)-1,8-naphthyridin-2-yl]phenyl]-1,8-naphthyridine
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc4c(n3)=NC(c3cc(-c5ccc6ccc(-c7ccc8c(c7)C(C)(C)c7ccccc7-8)nc6n5)cc(-c5ccc6ccc(-c7ccc8c(c7)C(C)(C)c7ccccc7-8)nc6n5)c3)CC=4)cc21
InChIInChI=1S/C75H56N6/c1-73(2)58-16-10-7-13-52(58)55-28-19-46(40-61(55)73)64-31-22-43-25-34-67(79-70(43)76-64)49-37-50(68-35-26-44-23-32-65(77-71(44)80-68)47-20-29-56-53-14-8-11-17-59(53)74(3,4)62(56)41-47)39-51(38-49)69-36-27-45-24-33-66(78-72(45)81-69)48-21-30-57-54-15-9-12-18-60(54)75(5,6)63(57)42-48/h7-35,37-42,69H,36H2,1-6H3
InChIKeyIDQRFXLBXBDPFT-UHFFFAOYSA-N
MW1041.31 g/mol
LogP16.77
Rot. Bonds6

About 2-(9,9-dimethylfluoren-2-yl)-7-[3-[7-(9,9-dimethylfluoren-2-yl)-2,3-dihydro-1,8-naphthyridin-2-yl]-5-[7-(9,9-dimethylfluoren-2-yl)-1,8-naphthyridin-2-yl]phenyl]-1,8-naphthyridine

2-(9,9-dimethylfluoren-2-yl)-7-[3-[7-(9,9-dimethylfluoren-2-yl)-2,3-dihydro-1,8-naphthyridin-2-yl]-5-[7-(9,9-dimethylfluoren-2-yl)-1,8-naphthyridin-2-yl]phenyl]-1,8-naphthyridine (PubChem CID 58771615) has the molecular formula C75H56N6 and a molecular weight of 1041.31 g/mol. Its IUPAC name is 2-(9,9-dimethylfluoren-2-yl)-7-[3-[7-(9,9-dimethylfluoren-2-yl)-2,3-dihydro-1,8-naphthyridin-2-yl]-5-[7-(9,9-dimethylfluoren-2-yl)-1,8-naphthyridin-2-yl]phenyl]-1,8-naphthyridine.

Molecular Properties

Compound Name2-(9,9-dimethylfluoren-2-yl)-7-[3-[7-(9,9-dimethylfluoren-2-yl)-2,3-dihydro-1,8-naphthyridin-2-yl]-5-[7-(9,9-dimethylfluoren-2-yl)-1,8-naphthyridin-2-yl]phenyl]-1,8-naphthyridine
PubChem CID58771615
Molecular FormulaC75H56N6
Molecular Weight1041.31 g/mol
Exact Mass1040.46
IUPAC Name2-(9,9-dimethylfluoren-2-yl)-7-[3-[7-(9,9-dimethylfluoren-2-yl)-2,3-dihydro-1,8-naphthyridin-2-yl]-5-[7-(9,9-dimethylfluoren-2-yl)-1,8-naphthyridin-2-yl]phenyl]-1,8-naphthyridine
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc4c(n3)=NC(c3cc(-c5ccc6ccc(-c7ccc8c(c7)C(C)(C)c7ccccc7-8)nc6n5)cc(-c5ccc6ccc(-c7ccc8c(c7)C(C)(C)c7ccccc7-8)nc6n5)c3)CC=4)cc21
InChIInChI=1S/C75H56N6/c1-73(2)58-16-10-7-13-52(58)55-28-19-46(40-61(55)73)64-31-22-43-25-34-67(79-70(43)76-64)49-37-50(68-35-26-44-23-32-65(77-71(44)80-68)47-20-29-56-53-14-8-11-17-59(53)74(3,4)62(56)41-47)39-51(38-49)69-36-27-45-24-33-66(78-72(45)81-69)48-21-30-57-54-15-9-12-18-60(54)75(5,6)63(57)42-48/h7-35,37-42,69H,36H2,1-6H3
InChIKeyIDQRFXLBXBDPFT-UHFFFAOYSA-N
XLogP16.77
TPSA76.81 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms81
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001041.31
LogP ≤ 516.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-(9,9-dimethylfluoren-2-yl)-7-[3-[7-(9,9-dimethylfluoren-2-yl)-2,3-dihydro-1,8-naphthyridin-2-yl]-5-[7-(9,9-dimethylfluoren-2-yl)-1,8-naphthyridin-2-yl]phenyl]-1,8-naphthyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(9,9-dimethylfluoren-2-yl)-7-[3-[7-(9,9-dimethylfluoren-2-yl)-2,3-dihydro-1,8-naphthyridin-2-yl]-5-[7-(9,9-dimethylfluoren-2-yl)-1,8-naphthyridin-2-yl]phenyl]-1,8-naphthyridine?
The IUPAC name of 2-(9,9-dimethylfluoren-2-yl)-7-[3-[7-(9,9-dimethylfluoren-2-yl)-2,3-dihydro-1,8-naphthyridin-2-yl]-5-[7-(9,9-dimethylfluoren-2-yl)-1,8-naphthyridin-2-yl]phenyl]-1,8-naphthyridine (CID 58771615) is 2-(9,9-dimethylfluoren-2-yl)-7-[3-[7-(9,9-dimethylfluoren-2-yl)-2,3-dihydro-1,8-naphthyridin-2-yl]-5-[7-(9,9-dimethylfluoren-2-yl)-1,8-naphthyridin-2-yl]phenyl]-1,8-naphthyridine.
What is the SMILES notation for 2-(9,9-dimethylfluoren-2-yl)-7-[3-[7-(9,9-dimethylfluoren-2-yl)-2,3-dihydro-1,8-naphthyridin-2-yl]-5-[7-(9,9-dimethylfluoren-2-yl)-1,8-naphthyridin-2-yl]phenyl]-1,8-naphthyridine?
The canonical SMILES for 2-(9,9-dimethylfluoren-2-yl)-7-[3-[7-(9,9-dimethylfluoren-2-yl)-2,3-dihydro-1,8-naphthyridin-2-yl]-5-[7-(9,9-dimethylfluoren-2-yl)-1,8-naphthyridin-2-yl]phenyl]-1,8-naphthyridine is CC1(C)c2ccccc2-c2ccc(-c3ccc4c(n3)=NC(c3cc(-c5ccc6ccc(-c7ccc8c(c7)C(C)(C)c7ccccc7-8)nc6n5)cc(-c5ccc6ccc(-c7ccc8c(c7)C(C)(C)c7ccccc7-8)nc6n5)c3)CC=4)cc21.
What is the InChIKey of 2-(9,9-dimethylfluoren-2-yl)-7-[3-[7-(9,9-dimethylfluoren-2-yl)-2,3-dihydro-1,8-naphthyridin-2-yl]-5-[7-(9,9-dimethylfluoren-2-yl)-1,8-naphthyridin-2-yl]phenyl]-1,8-naphthyridine?
The InChIKey is IDQRFXLBXBDPFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C75H56N6/c1-73(2)58-16-10-7-13-52(58)55-28-19-46(40-61(55)73)64-31-22-43-25-34-67(79-70(43)76-64)49-37-50(68-35-26-44-23-32-65(77-71(44)80-68)47-20-29-56-53-14-8-11-17-59(53)74(3,4)62(56)41-47)39-51(38-49)69-36-27-45-24-33-66(78-72(45)81-69)48-21-30-57-54-15-9-12-18-60(54)75(5,6)63(57)42-48/h7-35,37-42,69H,36H2,1-6H3.
What are the key properties of 2-(9,9-dimethylfluoren-2-yl)-7-[3-[7-(9,9-dimethylfluoren-2-yl)-2,3-dihydro-1,8-naphthyridin-2-yl]-5-[7-(9,9-dimethylfluoren-2-yl)-1,8-naphthyridin-2-yl]phenyl]-1,8-naphthyridine?
2-(9,9-dimethylfluoren-2-yl)-7-[3-[7-(9,9-dimethylfluoren-2-yl)-2,3-dihydro-1,8-naphthyridin-2-yl]-5-[7-(9,9-dimethylfluoren-2-yl)-1,8-naphthyridin-2-yl]phenyl]-1,8-naphthyridine has a molecular weight of 1041.31 g/mol, XLogP of 16.77, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(9,9-dimethylfluoren-2-yl)-7-[3-[7-(9,9-dimethylfluoren-2-yl)-2,3-dihydro-1,8-naphthyridin-2-yl]-5-[7-(9,9-dimethylfluoren-2-yl)-1,8-naphthyridin-2-yl]phenyl]-1,8-naphthyridine is sourced from PubChem (CID 58771615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).