9-(7,8-dipyridin-2-yldibenzofuran-2-yl)-3,6-bis(2-pyridin-2-ylphenyl)carbazole;methanamine;pyridine

C62H45N7O — CID 144536431

IUPAC9-(7,8-dipyridin-2-yldibenzofuran-2-yl)-3,6-bis(2-pyridin-2-ylphenyl)carbazole;methanamine;pyridine
SMILESCN.c1ccc(-c2ccccc2-c2ccc3c(c2)c2cc(-c4ccccc4-c4ccccn4)ccc2n3-c2ccc3oc4cc(-c5ccccn5)c(-c5ccccn5)cc4c3c2)nc1.c1ccncc1
InChIInChI=1S/C56H35N5O.C5H5N.CH5N/c1-3-15-41(49-17-5-9-27-57-49)39(13-1)36-21-24-53-45(31-36)46-32-37(40-14-2-4-16-42(40)50-18-6-10-28-58-50)22-25-54(46)61(53)38-23-26-55-47(33-38)48-34-43(51-19-7-11-29-59-51)44(35-56(48)62-55)52-20-8-12-30-60-52;1-2-4-6-5-3-1;1-2/h1-35H;1-5H;2H2,1H3
InChIKeyWYYVEKBWXJJQLZ-UHFFFAOYSA-N
MW904.09 g/mol
LogP14.92
Rot. Bonds7

About 9-(7,8-dipyridin-2-yldibenzofuran-2-yl)-3,6-bis(2-pyridin-2-ylphenyl)carbazole;methanamine;pyridine

9-(7,8-dipyridin-2-yldibenzofuran-2-yl)-3,6-bis(2-pyridin-2-ylphenyl)carbazole;methanamine;pyridine (PubChem CID 144536431) has the molecular formula C62H45N7O and a molecular weight of 904.09 g/mol. Its IUPAC name is 9-(7,8-dipyridin-2-yldibenzofuran-2-yl)-3,6-bis(2-pyridin-2-ylphenyl)carbazole;methanamine;pyridine.

Molecular Properties

Compound Name9-(7,8-dipyridin-2-yldibenzofuran-2-yl)-3,6-bis(2-pyridin-2-ylphenyl)carbazole;methanamine;pyridine
PubChem CID144536431
Molecular FormulaC62H45N7O
Molecular Weight904.09 g/mol
Exact Mass903.37
IUPAC Name9-(7,8-dipyridin-2-yldibenzofuran-2-yl)-3,6-bis(2-pyridin-2-ylphenyl)carbazole;methanamine;pyridine
SMILESCN.c1ccc(-c2ccccc2-c2ccc3c(c2)c2cc(-c4ccccc4-c4ccccn4)ccc2n3-c2ccc3oc4cc(-c5ccccn5)c(-c5ccccn5)cc4c3c2)nc1.c1ccncc1
InChIInChI=1S/C56H35N5O.C5H5N.CH5N/c1-3-15-41(49-17-5-9-27-57-49)39(13-1)36-21-24-53-45(31-36)46-32-37(40-14-2-4-16-42(40)50-18-6-10-28-58-50)22-25-54(46)61(53)38-23-26-55-47(33-38)48-34-43(51-19-7-11-29-59-51)44(35-56(48)62-55)52-20-8-12-30-60-52;1-2-4-6-5-3-1;1-2/h1-35H;1-5H;2H2,1H3
InChIKeyWYYVEKBWXJJQLZ-UHFFFAOYSA-N
XLogP14.92
TPSA108.54 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms70
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500904.09
LogP ≤ 514.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 9-(7,8-dipyridin-2-yldibenzofuran-2-yl)-3,6-bis(2-pyridin-2-ylphenyl)carbazole;methanamine;pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(4-ethenylphenyl)-9-[8-[3-(4-ethenylphenyl)-6-(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzofuran-2-yl]-6-(2-pyridin-2-ylphenyl)carbazole
CID 88853124
3-(2-pyridin-2-ylphenyl)-9-[7-[3-(2-pyridin-2-ylphenyl)carbazol-9-yl]dibenzofuran-3-yl]carbazole
CID 123136164
5-(8-iododibenzofuran-2-yl)-8-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indole
CID 67094853
8-(5-phenyl-3-pyridinyl)-5-[8-[8-(5-phenyl-3-pyridinyl)pyrido[3,2-b]indol-5-yl]dibenzofuran-2-yl]pyrido[3,2-b]indole;8-(3-pyridin-2-ylphenyl)-5-[8-[8-(3-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]dibenzofuran-2-yl]pyrido[3,2-b]indole;8-(3-pyridin-3-ylphenyl)-5-[8-[8-(3-pyridin-3-ylphenyl)pyrido[3,2-b]indol-5-yl]dibenzofuran-2-yl]pyrido[3,2-b]indole;8-(3-pyridin-4-ylphenyl)-5-[8-[8-(3-pyridin-4-ylphenyl)pyrido[3,2-b]indol-5-yl]dibenzofuran-2-yl]pyrido[3,2-b]indole;8-(2-pyridin-2-ylphenyl)-5-[8-[8-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]dibenzothiophen-2-yl]pyrido[3,2-b]indole
CID 160864468
9-[8-(3-isocyanocarbazol-9-yl)dibenzofuran-2-yl]carbazole-3-carbonitrile;3-(2-pyridin-2-ylphenyl)-9-[3-[3-(2-pyridin-2-ylphenyl)carbazol-9-yl]phenyl]carbazole
CID 159338990
5-(9-methylcarbazol-3-yl)-8-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indole
CID 58370085
3-(4-carbazol-9-yl-2-dibenzofuran-2-yl-5-pyridin-2-ylphenyl)-9-phenylcarbazole
CID 71278022
5-dibenzofuran-2-yl-8-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indole;5-dibenzothiophen-2-yl-8-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indole;5-phenylpyrido[3,2-b]indole;8-(2-pyridin-2-ylphenyl)-5-[8-[8-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]dibenzofuran-2-yl]pyrido[3,2-b]indole;8-(2-pyridin-2-ylphenyl)-5-[8-[8-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]dibenzothiophen-2-yl]pyrido[3,2-b]indole;8-(2-pyridin-2-ylphenyl)-5-[3-[8-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]phenyl]pyrido[3,2-b]indole;5-(3-pyrido[3,2-b]indol-5-ylphenyl)pyrido[3,2-b]indole
CID 157173487
3-(8-carbazol-9-yldibenzofuran-2-yl)-9-[8-[3-(8-carbazol-9-yldibenzofuran-2-yl)carbazol-9-yl]dibenzofuran-2-yl]carbazole;3-(8-carbazol-9-yldibenzofuran-2-yl)-9-[2-(3-phenyl-2-pyridinyl)phenyl]carbazole;9-[8-(3,6-dipyridin-2-ylcarbazol-9-yl)dibenzofuran-2-yl]-3,6-dipyridin-2-ylcarbazole;9-phenyl-3,6-bis(3-phenylcarbazol-9-yl)carbazole
CID 161188676
9-[8-[3,6-di(pyrazin-2-yl)carbazol-9-yl]dibenzofuran-2-yl]-3,6-di(pyrazin-2-yl)carbazole
CID 163813284
5,11-diphenylindolo[3,2-b]carbazole;9-phenyl-3-[16-(9-phenylcarbazol-3-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole;8-(2-pyridin-2-ylphenyl)-5-[8-[8-(2-pyridin-2-ylphenyl)pyrido[3,2-b]indol-5-yl]dibenzofuran-2-yl]pyrido[3,2-b]indole;9,18,27-trioxaheptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1(20),2(10),3,5,7,11(19),12,14,16,21,23,25-dodecaene;9,18,27-triphenyl-9,18,27-triazaheptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1,3,5,7,10,12,14,16,19,21,23,25-dodecaene
CID 165079740
3,6-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-pyridin-2-ylphenyl]carbazole
CID 138578511

Frequently Asked Questions

What is the IUPAC name of 9-(7,8-dipyridin-2-yldibenzofuran-2-yl)-3,6-bis(2-pyridin-2-ylphenyl)carbazole;methanamine;pyridine?
The IUPAC name of 9-(7,8-dipyridin-2-yldibenzofuran-2-yl)-3,6-bis(2-pyridin-2-ylphenyl)carbazole;methanamine;pyridine (CID 144536431) is 9-(7,8-dipyridin-2-yldibenzofuran-2-yl)-3,6-bis(2-pyridin-2-ylphenyl)carbazole;methanamine;pyridine.
What is the SMILES notation for 9-(7,8-dipyridin-2-yldibenzofuran-2-yl)-3,6-bis(2-pyridin-2-ylphenyl)carbazole;methanamine;pyridine?
The canonical SMILES for 9-(7,8-dipyridin-2-yldibenzofuran-2-yl)-3,6-bis(2-pyridin-2-ylphenyl)carbazole;methanamine;pyridine is CN.c1ccc(-c2ccccc2-c2ccc3c(c2)c2cc(-c4ccccc4-c4ccccn4)ccc2n3-c2ccc3oc4cc(-c5ccccn5)c(-c5ccccn5)cc4c3c2)nc1.c1ccncc1.
What is the InChIKey of 9-(7,8-dipyridin-2-yldibenzofuran-2-yl)-3,6-bis(2-pyridin-2-ylphenyl)carbazole;methanamine;pyridine?
The InChIKey is WYYVEKBWXJJQLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H35N5O.C5H5N.CH5N/c1-3-15-41(49-17-5-9-27-57-49)39(13-1)36-21-24-53-45(31-36)46-32-37(40-14-2-4-16-42(40)50-18-6-10-28-58-50)22-25-54(46)61(53)38-23-26-55-47(33-38)48-34-43(51-19-7-11-29-59-51)44(35-56(48)62-55)52-20-8-12-30-60-52;1-2-4-6-5-3-1;1-2/h1-35H;1-5H;2H2,1H3.
What are the key properties of 9-(7,8-dipyridin-2-yldibenzofuran-2-yl)-3,6-bis(2-pyridin-2-ylphenyl)carbazole;methanamine;pyridine?
9-(7,8-dipyridin-2-yldibenzofuran-2-yl)-3,6-bis(2-pyridin-2-ylphenyl)carbazole;methanamine;pyridine has a molecular weight of 904.09 g/mol, XLogP of 14.92, 7 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(7,8-dipyridin-2-yldibenzofuran-2-yl)-3,6-bis(2-pyridin-2-ylphenyl)carbazole;methanamine;pyridine is sourced from PubChem (CID 144536431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).