7-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one;7-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,5]naphthyridin-3-one

C86H68ClN17O5 — CID 159661956

IUPAC7-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one;7-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,5]naphthyridin-3-one
SMILESCc1ccc(-n2[nH]c3c(cnc4cc(C)ccc43)c2=O)cc1.Cc1ccc(-n2[nH]c3c(cnc4cc(Cl)ncc43)c2=O)cc1.Cc1ccc(-n2[nH]c3c(cnc4cccnc43)c2=O)cc1.Cc1ccc2c(c1)ncc1c(=O)n(-c3ccccc3C)[nH]c12.Cc1cccc(-n2[nH]c3c(cnc4cc(C)ccc43)c2=O)c1
InChIInChI=1S/3C18H15N3O.C16H11ClN4O.C16H12N4O/c1-11-3-6-13(7-4-11)21-18(22)15-10-19-16-9-12(2)5-8-14(16)17(15)20-21;1-11-4-3-5-13(8-11)21-18(22)15-10-19-16-9-12(2)6-7-14(16)17(15)20-21;1-11-7-8-13-15(9-11)19-10-14-17(13)20-21(18(14)22)16-6-4-3-5-12(16)2;1-9-2-4-10(5-3-9)21-16(22)12-8-18-13-6-14(17)19-7-11(13)15(12)20-21;1-10-4-6-11(7-5-10)20-16(21)12-9-18-13-3-2-8-17-15(13)14(12)19-20/h3*3-10,20H,1-2H3;2-8,20H,1H3;2-9,19H,1H3
InChIKeyQEPBHPFWSVVFJE-UHFFFAOYSA-N
MW1455.06 g/mol
LogP16.25
Rot. Bonds5

About 7-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one;7-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,5]naphthyridin-3-one

7-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one;7-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,5]naphthyridin-3-one (PubChem CID 159661956) has the molecular formula C86H68ClN17O5 and a molecular weight of 1455.06 g/mol. Its IUPAC name is 7-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one;7-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,5]naphthyridin-3-one.

Molecular Properties

Compound Name7-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one;7-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,5]naphthyridin-3-one
PubChem CID159661956
Molecular FormulaC86H68ClN17O5
Molecular Weight1455.06 g/mol
Exact Mass1453.53
IUPAC Name7-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one;7-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,5]naphthyridin-3-one
SMILESCc1ccc(-n2[nH]c3c(cnc4cc(C)ccc43)c2=O)cc1.Cc1ccc(-n2[nH]c3c(cnc4cc(Cl)ncc43)c2=O)cc1.Cc1ccc(-n2[nH]c3c(cnc4cccnc43)c2=O)cc1.Cc1ccc2c(c1)ncc1c(=O)n(-c3ccccc3C)[nH]c12.Cc1cccc(-n2[nH]c3c(cnc4cc(C)ccc43)c2=O)c1
InChIInChI=1S/3C18H15N3O.C16H11ClN4O.C16H12N4O/c1-11-3-6-13(7-4-11)21-18(22)15-10-19-16-9-12(2)5-8-14(16)17(15)20-21;1-11-4-3-5-13(8-11)21-18(22)15-10-19-16-9-12(2)6-7-14(16)17(15)20-21;1-11-7-8-13-15(9-11)19-10-14-17(13)20-21(18(14)22)16-6-4-3-5-12(16)2;1-9-2-4-10(5-3-9)21-16(22)12-8-18-13-6-14(17)19-7-11(13)15(12)20-21;1-10-4-6-11(7-5-10)20-16(21)12-9-18-13-3-2-8-17-15(13)14(12)19-20/h3*3-10,20H,1-2H3;2-8,20H,1H3;2-9,19H,1H3
InChIKeyQEPBHPFWSVVFJE-UHFFFAOYSA-N
XLogP16.25
TPSA279.18 Ų
H-Bond Donors5
H-Bond Acceptors17
Rotatable Bonds5
Heavy Atoms109
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001455.06
LogP ≤ 516.25
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het_65_B(7)', 'substructure': 'N/A'}, {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 7-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one;7-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,5]naphthyridin-3-one with MolForge

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Related Compounds

7-[[6-chloro-3-(trifluoromethyl)pyridazin-4-yl]methyl]-4-(1-methylpyrazol-4-yl)quinoline-2-carboxamide;7-[[2-chloro-6-(trifluoromethyl)-4-pyridinyl]methyl]-4-(1-methylpyrazol-4-yl)quinoline-2-carboxamide;7-[(2,6-dimethyl-4-pyridinyl)methyl]-4-(1-methylpyrazol-4-yl)quinoline-2-carboxamide;methane;4-(2-methyl-1H-pyrazol-2-ium-4-yl)-7-[[2-(trifluoromethyl)-4-pyridinyl]methyl]quinoline-2-carboxamide;1-[4-(1-methylpyrazol-4-yl)-7-[[6-(trifluoromethyl)-2-pyridinyl]methyl]quinolin-2-yl]ethanone
CID 157331488
5-(6-chloro-3-pyridinyl)-N-pyridin-4-yl-1H-indazole-3-carboxamide;5-(1H-pyrazol-4-yl)-N-pyridin-4-yl-1H-indazole-3-carboxamide;N-pyridin-4-yl-5-(1H-pyrrolo[2,3-c]pyridin-4-yl)-1H-indazole-3-carboxamide
CID 87064627
7-chloro-8-morpholin-4-yl-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;7-chloro-2-phenyl-8-piperazin-1-yl-1H-pyrazolo[4,3-c]quinolin-3-one;6-fluoro-2-phenyl-7-(4-propan-2-ylpiperazin-1-yl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-methyl-6-(4-methylpiperazin-1-yl)-2-phenyl-1H-pyrazolo[4,3-c]quinolin-3-one;8-methyl-2-phenyl-6-piperazin-1-yl-1H-pyrazolo[4,3-c]quinolin-3-one
CID 123652476
6-[[4-(6-chloro-5-methyl-3-pyridinyl)-2-fluorophenyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;6-[[2-fluoro-5-(2-methylindazol-5-yl)phenyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;6-[(2-fluoro-4-pyridin-3-ylphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;6-[(2-fluoro-4-quinolin-6-ylphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;6-[[2-methyl-5-(2-methylindazol-4-yl)phenyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one
CID 157079150
N-(2-chlorophenyl)-2-[1-[3-[2-(2,6-dimethyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-(2-chlorophenyl)-2-[1-[2-fluoro-5-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-(2-chlorophenyl)-2-[1-[3-[2-(2-methylindazol-5-yl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-(2-chlorophenyl)-2-[1-[3-[2-(1,5-naphthyridin-4-yl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-(2-chlorophenyl)-2-[1-[3-[2-(2-oxo-1,3-dihydroindol-5-yl)acetyl]phenyl]pyrazol-4-yl]acetamide;1-[3-[4-[2-(1,3-dihydroisoindol-2-yl)-2-oxoethyl]pyrazol-1-yl]phenyl]-2-(2-methyl-4-pyridinyl)ethanone
CID 157291163
8-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-methyl-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;8-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one
CID 157303205
8-chloro-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;bis(7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one);7-methyl-2-(6-methyl-3-pyridinyl)-1H-pyrazolo[4,3-c]quinolin-3-one;[2-(4-methylphenyl)-1,3-dihydropyrazolo[4,3-c]quinolin-7-yl]methanol
CID 157387033
6-[[4-(6-chloro-5-methyl-3-pyridinyl)-2-fluorophenyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;6-[(2-fluoro-4-isoquinolin-6-ylphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;6-[[2-fluoro-3-(2-methylindazol-4-yl)phenyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;6-[[2-fluoro-5-(2-methylindazol-5-yl)phenyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;6-[(2-fluoro-4-quinolin-4-ylphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one
CID 157457070
6-[[4-(6-chloro-5-methyl-3-pyridinyl)-2-fluorophenyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;6-[[2-fluoro-3-(2-methylindazol-4-yl)phenyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;6-[[2-fluoro-5-(2-methylindazol-6-yl)phenyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;6-[(2-fluoro-4-quinolin-4-ylphenyl)methyl]-7H-pyrrolo[3,4-b]pyridin-5-one;6-[[2-methyl-5-(2-methylindazol-4-yl)phenyl]methyl]-7H-pyrrolo[3,4-b]pyridin-5-one
CID 157483878
Carbon dioxide;13-chloro-1-azahexacyclo[14.7.1.02,7.08,24.010,15.017,22]tetracosa-2,4,6,8(24),9,11,13,15,17,19,21-undecaen-23-one;22-methyl-3,13,23-triazahexacyclo[11.10.1.02,11.04,9.014,19.020,24]tetracosa-1(23),2,4,6,8,10,14,16,18,20(24),21-undecaen-12-one;4-phenyl-3,13-diazahexacyclo[11.10.1.02,11.05,10.014,19.020,24]tetracosa-1(23),2(11),3,5,7,9,14,16,18,20(24),21-undecaen-12-one;3,10,13-triazahexacyclo[11.10.1.02,11.04,9.014,19.020,24]tetracosa-1(23),2,4,6,8,10,14,16,18,20(24),21-undecaene;3,10,13-triazahexacyclo[11.10.1.02,11.04,9.014,19.020,24]tetracosa-1(23),2,4,6,8,10,14,16,18,20(24),21-undecaen-12-one
CID 157540550
tris(8-bromo-6-fluoro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one);8-chloro-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one
CID 157857603
7-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one;2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,5]naphthyridin-3-one
CID 158066985

Frequently Asked Questions

What is the IUPAC name of 7-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one;7-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,5]naphthyridin-3-one?
The IUPAC name of 7-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one;7-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,5]naphthyridin-3-one (CID 159661956) is 7-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one;7-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,5]naphthyridin-3-one.
What is the SMILES notation for 7-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one;7-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,5]naphthyridin-3-one?
The canonical SMILES for 7-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one;7-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,5]naphthyridin-3-one is Cc1ccc(-n2[nH]c3c(cnc4cc(C)ccc43)c2=O)cc1.Cc1ccc(-n2[nH]c3c(cnc4cc(Cl)ncc43)c2=O)cc1.Cc1ccc(-n2[nH]c3c(cnc4cccnc43)c2=O)cc1.Cc1ccc2c(c1)ncc1c(=O)n(-c3ccccc3C)[nH]c12.Cc1cccc(-n2[nH]c3c(cnc4cc(C)ccc43)c2=O)c1.
What is the InChIKey of 7-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one;7-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,5]naphthyridin-3-one?
The InChIKey is QEPBHPFWSVVFJE-UHFFFAOYSA-N. The full InChI is InChI=1S/3C18H15N3O.C16H11ClN4O.C16H12N4O/c1-11-3-6-13(7-4-11)21-18(22)15-10-19-16-9-12(2)5-8-14(16)17(15)20-21;1-11-4-3-5-13(8-11)21-18(22)15-10-19-16-9-12(2)6-7-14(16)17(15)20-21;1-11-7-8-13-15(9-11)19-10-14-17(13)20-21(18(14)22)16-6-4-3-5-12(16)2;1-9-2-4-10(5-3-9)21-16(22)12-8-18-13-6-14(17)19-7-11(13)15(12)20-21;1-10-4-6-11(7-5-10)20-16(21)12-9-18-13-3-2-8-17-15(13)14(12)19-20/h3*3-10,20H,1-2H3;2-8,20H,1H3;2-9,19H,1H3.
What are the key properties of 7-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one;7-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,5]naphthyridin-3-one?
7-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one;7-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,5]naphthyridin-3-one has a molecular weight of 1455.06 g/mol, XLogP of 16.25, 5 rotatable bonds, 5 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,6]naphthyridin-3-one;7-methyl-2-(2-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(3-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;7-methyl-2-(4-methylphenyl)-1H-pyrazolo[4,3-c]quinolin-3-one;2-(4-methylphenyl)-1H-pyrazolo[4,3-c][1,5]naphthyridin-3-one is sourced from PubChem (CID 159661956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).