2-(3,5-dinaphthalen-2-ylphenyl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(10-naphthalen-2-ylanthracen-9-yl)pyrazolo[1,5-a]quinoline;2-pyrido[1,2-b]indazol-8-ylpyrazolo[1,5-a]quinoline

C121H78N12 — CID 157160356

IUPAC2-(3,5-dinaphthalen-2-ylphenyl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(10-naphthalen-2-ylanthracen-9-yl)pyrazolo[1,5-a]quinoline;2-pyrido[1,2-b]indazol-8-ylpyrazolo[1,5-a]quinoline
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3cc4ccc5ccccc5n4n3)n2)cc1.c1ccc2c(c1)ccc1cc(-c3ccc4c5ccccc5nn4c3)nn12.c1ccc2cc(-c3c4ccccc4c(-c4cc5ccc6ccccc6n5n4)c4ccccc34)ccc2c1.c1ccc2cc(-c3cc(-c4ccc5ccccc5c4)cc(-c4cc5ccc6ccccc6n5n4)c3)ccc2c1
InChIInChI=1S/C37H24N2.C35H22N2.C27H18N4.C22H14N4/c1-3-10-28-19-30(15-13-25(28)7-1)32-21-33(31-16-14-26-8-2-4-11-29(26)20-31)23-34(22-32)36-24-35-18-17-27-9-5-6-12-37(27)39(35)38-36;1-2-11-25-21-26(18-17-23(25)9-1)34-28-12-4-6-14-30(28)35(31-15-7-5-13-29(31)34)32-22-27-20-19-24-10-3-8-16-33(24)37(27)36-32;1-3-9-19(10-4-1)23-18-24(20-11-5-2-6-12-20)29-27(28-23)25-17-22-16-15-21-13-7-8-14-26(21)31(22)30-25;1-4-8-21-15(5-1)9-11-17-13-20(24-26(17)21)16-10-12-22-18-6-2-3-7-19(18)23-25(22)14-16/h1-24H;1-22H;1-18H;1-14H
InChIKeyAMHMHSTYMBVKLC-UHFFFAOYSA-N
MW1700.04 g/mol
LogP30.31
Rot. Bonds9

About 2-(3,5-dinaphthalen-2-ylphenyl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(10-naphthalen-2-ylanthracen-9-yl)pyrazolo[1,5-a]quinoline;2-pyrido[1,2-b]indazol-8-ylpyrazolo[1,5-a]quinoline

2-(3,5-dinaphthalen-2-ylphenyl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(10-naphthalen-2-ylanthracen-9-yl)pyrazolo[1,5-a]quinoline;2-pyrido[1,2-b]indazol-8-ylpyrazolo[1,5-a]quinoline (PubChem CID 157160356) has the molecular formula C121H78N12 and a molecular weight of 1700.04 g/mol. Its IUPAC name is 2-(3,5-dinaphthalen-2-ylphenyl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(10-naphthalen-2-ylanthracen-9-yl)pyrazolo[1,5-a]quinoline;2-pyrido[1,2-b]indazol-8-ylpyrazolo[1,5-a]quinoline.

Molecular Properties

Compound Name2-(3,5-dinaphthalen-2-ylphenyl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(10-naphthalen-2-ylanthracen-9-yl)pyrazolo[1,5-a]quinoline;2-pyrido[1,2-b]indazol-8-ylpyrazolo[1,5-a]quinoline
PubChem CID157160356
Molecular FormulaC121H78N12
Molecular Weight1700.04 g/mol
Exact Mass1698.65
IUPAC Name2-(3,5-dinaphthalen-2-ylphenyl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(10-naphthalen-2-ylanthracen-9-yl)pyrazolo[1,5-a]quinoline;2-pyrido[1,2-b]indazol-8-ylpyrazolo[1,5-a]quinoline
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3cc4ccc5ccccc5n4n3)n2)cc1.c1ccc2c(c1)ccc1cc(-c3ccc4c5ccccc5nn4c3)nn12.c1ccc2cc(-c3c4ccccc4c(-c4cc5ccc6ccccc6n5n4)c4ccccc34)ccc2c1.c1ccc2cc(-c3cc(-c4ccc5ccccc5c4)cc(-c4cc5ccc6ccccc6n5n4)c3)ccc2c1
InChIInChI=1S/C37H24N2.C35H22N2.C27H18N4.C22H14N4/c1-3-10-28-19-30(15-13-25(28)7-1)32-21-33(31-16-14-26-8-2-4-11-29(26)20-31)23-34(22-32)36-24-35-18-17-27-9-5-6-12-37(27)39(35)38-36;1-2-11-25-21-26(18-17-23(25)9-1)34-28-12-4-6-14-30(28)35(31-15-7-5-13-29(31)34)32-22-27-20-19-24-10-3-8-16-33(24)37(27)36-32;1-3-9-19(10-4-1)23-18-24(20-11-5-2-6-12-20)29-27(28-23)25-17-22-16-15-21-13-7-8-14-26(21)31(22)30-25;1-4-8-21-15(5-1)9-11-17-13-20(24-26(17)21)16-10-12-22-18-6-2-3-7-19(18)23-25(22)14-16/h1-24H;1-22H;1-18H;1-14H
InChIKeyAMHMHSTYMBVKLC-UHFFFAOYSA-N
XLogP30.31
TPSA112.28 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds9
Heavy Atoms133
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001700.04
LogP ≤ 530.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 2-(3,5-dinaphthalen-2-ylphenyl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(10-naphthalen-2-ylanthracen-9-yl)pyrazolo[1,5-a]quinoline;2-pyrido[1,2-b]indazol-8-ylpyrazolo[1,5-a]quinoline with MolForge

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Related Compounds

3-(1H-indazol-4-yl)-7-(4-((1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl)naphthalen-1-yl)-2-(pyridin-4-yl)pyrazolo[1,5-a]pyrimidine
CID 49836649
2-Methyl-1-[2-[2-[6-phenyl-2-(2-phenylphenyl)-3-pyridinyl]phenyl]phenyl]benzimidazole;3-[2-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]-2-[3-[2-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]-2-pyridinyl]pyridine
CID 91366751
12-[2-[7,8-Diethyl-7-methyl-4-(trifluoromethyl)-5,6-diaza-9-azoniatricyclo[7.4.0.02,6]trideca-1(13),2,4,9,11-pentaen-8-yl]ethyl]-16-methyl-4,9,16-triaza-11-azoniahexacyclo[11.11.0.02,11.05,10.015,23.017,22]tetracosa-1(13),2,4,6,8,10,14,17,19,21,23-undecaene
CID 123631446
12-[2-[7,8-Diethyl-7-methyl-4-(trifluoromethyl)-5,6-diaza-9-azoniatricyclo[7.4.0.02,6]trideca-1(13),2,4,9,11-pentaen-8-yl]ethyl]-22-ethyl-6,9,22-triaza-11-azoniahexacyclo[11.11.0.02,11.05,10.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene
CID 123704958
4-[3-[3-[(4-fluorophenyl)methyl]-1-methylpyrazol-4-yl]-[1,2,4]triazolo[4,3-a]pyridin-7-yl]-6-[2-methyl-5-[1-[2-[7-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]ethyl]triazol-4-yl]phenyl]-N-(2-methylpyrazol-3-yl)pyrimidin-2-amine
CID 123831832
2-[2-[6-[2-[2-[6-[2-[2-(5,8-Dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]quinolin-6-yl]-5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl]ethyl]-3-fluoroquinolin-6-yl]-5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl]ethyl]-7,8-dimethylquinoline
CID 124036193
4-[4-[2-[9-[2-Cyano-3-[3-[5-[2-[9-[2-cyano-3-[2,7-di(pyrimidin-2-yl)carbazol-9-yl]-5-[2-(trifluoromethyl)phenyl]phenyl]-7-pyrimidin-2-ylcarbazol-2-yl]pyrimidin-5-yl]pyrimidin-2-yl]-6-pyrimidin-2-ylcarbazol-9-yl]-5-[2-(trifluoromethyl)phenyl]phenyl]-6-pyrimidin-2-ylcarbazol-3-yl]pyrimidin-5-yl]-2-(trifluoromethyl)phenyl]-2,6-bis(3-pyrimidin-2-ylcarbazol-9-yl)benzonitrile
CID 137386454
3-Fluoro-7-[3-[1-[[1-fluoro-2-[7-[3-[5-fluoro-1-[[1-fluoro-2-[6-[3-[5-fluoro-1-[[1-fluoro-2-[5-[3-[5-fluoro-1-[(1-fluorocyclopentyl)methyl]pyrazol-4-yl]-6-methyl-2-pyridinyl]benzimidazol-1-yl]cyclopentyl]methyl]pyrazol-4-yl]-6-methyl-2-pyridinyl]imidazo[4,5-b]pyridin-3-yl]cyclopentyl]methyl]pyrazol-4-yl]-6-methyl-2-pyridinyl]quinolin-4-yl]cyclopentyl]methyl]pyrazol-4-yl]-6-methyl-2-pyridinyl]quinoline
CID 137391920
9-[4-[4-[3-[2-[6-(4-Carbazol-9-yl-2,3,5,6-tetrafluorophenyl)-2-[4-[6-[4-(4-carbazol-9-yl-2,3,5,6-tetrafluorophenyl)-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]phenyl]pyrimidin-4-yl]-4-pyridinyl]phenyl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-2,3,5,6-tetrafluorophenyl]carbazole
CID 138593212
9-[4-[4-[6-[6-(3,6-Difluorocarbazol-9-yl)-2-[4-[6-[4-(3,6-difluorocarbazol-9-yl)-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]phenyl]pyrimidin-4-yl]-3-pyridinyl]phenyl]-6-pyridin-2-yl-1,3,5-triazin-2-yl]-3,6-difluorocarbazole
CID 138593219
1-[(4R,5S)-5-[5-(difluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-2-[(4R,5S)-5-[5-(difluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-4-methyl-1-quinolin-4-ylpiperidin-2-yl]-4-methylpiperidin-1-yl]-8-methylisoquinoline
CID 142341233
N-[8-[3-[3-[bis(8-fluoro-3-methylimidazo[2,1-a]isoquinolin-2-yl)amino]-5-tert-butylphenyl]-3-methylbutyl]-3-(2,2-dimethylpropyl)imidazo[2,1-a]isoquinolin-2-yl]-N-(2-tert-butylpyrimidin-5-yl)-3-(2,2-dimethylpropyl)-8-methylimidazo[2,1-a]isoquinolin-2-amine
CID 144497952

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dinaphthalen-2-ylphenyl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(10-naphthalen-2-ylanthracen-9-yl)pyrazolo[1,5-a]quinoline;2-pyrido[1,2-b]indazol-8-ylpyrazolo[1,5-a]quinoline?
The IUPAC name of 2-(3,5-dinaphthalen-2-ylphenyl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(10-naphthalen-2-ylanthracen-9-yl)pyrazolo[1,5-a]quinoline;2-pyrido[1,2-b]indazol-8-ylpyrazolo[1,5-a]quinoline (CID 157160356) is 2-(3,5-dinaphthalen-2-ylphenyl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(10-naphthalen-2-ylanthracen-9-yl)pyrazolo[1,5-a]quinoline;2-pyrido[1,2-b]indazol-8-ylpyrazolo[1,5-a]quinoline.
What is the SMILES notation for 2-(3,5-dinaphthalen-2-ylphenyl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(10-naphthalen-2-ylanthracen-9-yl)pyrazolo[1,5-a]quinoline;2-pyrido[1,2-b]indazol-8-ylpyrazolo[1,5-a]quinoline?
The canonical SMILES for 2-(3,5-dinaphthalen-2-ylphenyl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(10-naphthalen-2-ylanthracen-9-yl)pyrazolo[1,5-a]quinoline;2-pyrido[1,2-b]indazol-8-ylpyrazolo[1,5-a]quinoline is c1ccc(-c2cc(-c3ccccc3)nc(-c3cc4ccc5ccccc5n4n3)n2)cc1.c1ccc2c(c1)ccc1cc(-c3ccc4c5ccccc5nn4c3)nn12.c1ccc2cc(-c3c4ccccc4c(-c4cc5ccc6ccccc6n5n4)c4ccccc34)ccc2c1.c1ccc2cc(-c3cc(-c4ccc5ccccc5c4)cc(-c4cc5ccc6ccccc6n5n4)c3)ccc2c1.
What is the InChIKey of 2-(3,5-dinaphthalen-2-ylphenyl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(10-naphthalen-2-ylanthracen-9-yl)pyrazolo[1,5-a]quinoline;2-pyrido[1,2-b]indazol-8-ylpyrazolo[1,5-a]quinoline?
The InChIKey is AMHMHSTYMBVKLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H24N2.C35H22N2.C27H18N4.C22H14N4/c1-3-10-28-19-30(15-13-25(28)7-1)32-21-33(31-16-14-26-8-2-4-11-29(26)20-31)23-34(22-32)36-24-35-18-17-27-9-5-6-12-37(27)39(35)38-36;1-2-11-25-21-26(18-17-23(25)9-1)34-28-12-4-6-14-30(28)35(31-15-7-5-13-29(31)34)32-22-27-20-19-24-10-3-8-16-33(24)37(27)36-32;1-3-9-19(10-4-1)23-18-24(20-11-5-2-6-12-20)29-27(28-23)25-17-22-16-15-21-13-7-8-14-26(21)31(22)30-25;1-4-8-21-15(5-1)9-11-17-13-20(24-26(17)21)16-10-12-22-18-6-2-3-7-19(18)23-25(22)14-16/h1-24H;1-22H;1-18H;1-14H.
What are the key properties of 2-(3,5-dinaphthalen-2-ylphenyl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(10-naphthalen-2-ylanthracen-9-yl)pyrazolo[1,5-a]quinoline;2-pyrido[1,2-b]indazol-8-ylpyrazolo[1,5-a]quinoline?
2-(3,5-dinaphthalen-2-ylphenyl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(10-naphthalen-2-ylanthracen-9-yl)pyrazolo[1,5-a]quinoline;2-pyrido[1,2-b]indazol-8-ylpyrazolo[1,5-a]quinoline has a molecular weight of 1700.04 g/mol, XLogP of 30.31, 9 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dinaphthalen-2-ylphenyl)pyrazolo[1,5-a]quinoline;2-(4,6-diphenylpyrimidin-2-yl)pyrazolo[1,5-a]quinoline;2-(10-naphthalen-2-ylanthracen-9-yl)pyrazolo[1,5-a]quinoline;2-pyrido[1,2-b]indazol-8-ylpyrazolo[1,5-a]quinoline is sourced from PubChem (CID 157160356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).