5-(3-aminopropyl)-3-methyl-8-(2-methylpyrazol-3-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-2-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one

C105H109N31O7S2 — CID 158633154

IUPAC5-(3-aminopropyl)-3-methyl-8-(2-methylpyrazol-3-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-2-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one
SMILESCc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3cccs3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3ccn[nH]3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3ccnn3C)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3ccsc3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3cn[nH]c3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3ncco3)cc21
InChIInChI=1S/C18H20N6O.2C18H18N4OS.2C17H18N6O.C17H17N5O2/c1-11-16-17(22-21-11)13-10-12(14-6-8-20-23(14)2)4-5-15(13)24(18(16)25)9-3-7-19;1-11-16-17(21-20-11)14-9-12(13-5-8-24-10-13)3-4-15(14)22(18(16)23)7-2-6-19;1-11-16-17(21-20-11)13-10-12(15-4-2-9-24-15)5-6-14(13)22(18(16)23)8-3-7-19;1-10-15-16(22-20-10)12-9-11(13-5-7-19-21-13)3-4-14(12)23(17(15)24)8-2-6-18;1-10-15-16(22-21-10)13-7-11(12-8-19-20-9-12)3-4-14(13)23(17(15)24)6-2-5-18;1-10-14-15(21-20-10)12-9-11(16-19-6-8-24-16)3-4-13(12)22(17(14)23)7-2-5-18/h4-6,8,10H,3,7,9,19H2,1-2H3,(H,21,22);3-5,8-10H,2,6-7,19H2,1H3,(H,20,21);2,4-6,9-10H,3,7-8,19H2,1H3,(H,20,21);3-5,7,9H,2,6,8,18H2,1H3,(H,19,21)(H,20,22);3-4,7-9H,2,5-6,18H2,1H3,(H,19,20)(H,21,22);3-4,6,8-9H,2,5,7,18H2,1H3,(H,20,21)
InChIKeyHZLCURXSFWTQIV-UHFFFAOYSA-N
MW1981.37 g/mol
LogP14.50
Rot. Bonds24

About 5-(3-aminopropyl)-3-methyl-8-(2-methylpyrazol-3-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-2-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one

5-(3-aminopropyl)-3-methyl-8-(2-methylpyrazol-3-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-2-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one (PubChem CID 158633154) has the molecular formula C105H109N31O7S2 and a molecular weight of 1981.37 g/mol. Its IUPAC name is 5-(3-aminopropyl)-3-methyl-8-(2-methylpyrazol-3-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-2-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one.

Molecular Properties

Compound Name5-(3-aminopropyl)-3-methyl-8-(2-methylpyrazol-3-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-2-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one
PubChem CID158633154
Molecular FormulaC105H109N31O7S2
Molecular Weight1981.37 g/mol
Exact Mass1979.86
IUPAC Name5-(3-aminopropyl)-3-methyl-8-(2-methylpyrazol-3-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-2-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one
SMILESCc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3cccs3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3ccn[nH]3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3ccnn3C)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3ccsc3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3cn[nH]c3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3ncco3)cc21
InChIInChI=1S/C18H20N6O.2C18H18N4OS.2C17H18N6O.C17H17N5O2/c1-11-16-17(22-21-11)13-10-12(14-6-8-20-23(14)2)4-5-15(13)24(18(16)25)9-3-7-19;1-11-16-17(21-20-11)14-9-12(13-5-8-24-10-13)3-4-15(14)22(18(16)23)7-2-6-19;1-11-16-17(21-20-11)13-10-12(15-4-2-9-24-15)5-6-14(13)22(18(16)23)8-3-7-19;1-10-15-16(22-20-10)12-9-11(13-5-7-19-21-13)3-4-14(12)23(17(15)24)8-2-6-18;1-10-15-16(22-21-10)13-7-11(12-8-19-20-9-12)3-4-14(13)23(17(15)24)6-2-5-18;1-10-14-15(21-20-10)12-9-11(16-19-6-8-24-16)3-4-13(12)22(17(14)23)7-2-5-18/h4-6,8,10H,3,7,9,19H2,1-2H3,(H,21,22);3-5,8-10H,2,6-7,19H2,1H3,(H,20,21);2,4-6,9-10H,3,7-8,19H2,1H3,(H,20,21);3-5,7,9H,2,6,8,18H2,1H3,(H,19,21)(H,20,22);3-4,7-9H,2,5-6,18H2,1H3,(H,19,20)(H,21,22);3-4,6,8-9H,2,5,7,18H2,1H3,(H,20,21)
InChIKeyHZLCURXSFWTQIV-UHFFFAOYSA-N
XLogP14.50
TPSA561.41 Ų
H-Bond Donors14
H-Bond Acceptors32
Rotatable Bonds24
Heavy Atoms145
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001981.37
LogP ≤ 514.50
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1032

Analyze 5-(3-aminopropyl)-3-methyl-8-(2-methylpyrazol-3-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-2-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one with MolForge

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Related Compounds

2-(6,6-Dipyridin-3-yl-1,7-dihydroindazol-3-yl)-1,3-oxazole;4-(6,6-dipyridin-3-yl-1,7-dihydroindazol-3-yl)-1,3-oxazole;6,6-dipyridin-3-yl-3-thiophen-3-yl-1,7-dihydroindazole
CID 157102456
5-(3-aminopropyl)-8-(furan-3-yl)-3-(2-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-8-(furan-2-yl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-thiazol-2-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-thiazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-butyl-3-methyl-8-(1,3-thiazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one
CID 157276337
5-(3-aminopropyl)-3-methyl-8-(1-methylpyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-thiazol-2-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-thiazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-thiazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one
CID 157754421
2-[6-[3-[2-(1,3-benzothiazol-2-yl)-1H-carbazol-1-id-9-yl]-4-(3H-pyrrol-2-yl)benzene-2-id-1-yl]-3-pyridinyl]-1,3-oxazole;2-[6-[3-[2-(1,3-benzothiazol-2-yl)-6-(1,3-oxazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-oxazole;2-[7-[6-(1,3-oxazol-2-yl)-1,3-benzothiazol-2-yl]-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-8H-carbazol-8-id-3-yl]-1,3-oxazole;tris(platinum(2+))
CID 158225217
7-(5-methylfuran-2-yl)-3-(1H-pyrazol-5-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one;7-(5-methylfuran-2-yl)-3-(1H-pyrrol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one;7-(2-methyl-1,3-thiazol-5-yl)-3-(1,3-oxazol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one;7-(2-methyl-1,3-thiazol-5-yl)-3-(1H-pyrrol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one;7-(5-methylthiophen-2-yl)-3-(1H-pyrazol-5-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one;7-(5-methylthiophen-2-yl)-3-(1H-pyrrol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one
CID 159272087
bis(cyclopenta-1,3-dien-1-yl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone);furan-2-yl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;1H-indol-3-yl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(3-methylfuran-2-yl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(5-methylfuran-2-yl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-pyridin-2-ylmethanone;(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-(2H-pyrrol-5-yl)methanone;(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-thiophen-3-ylmethanone
CID 159479057
2-[6-[3-[2-(1,3-benzothiazol-2-yl)-6-(1,3-oxazol-2-yl)-1H-carbazol-1-id-9-yl]benzene-2-id-1-yl]-3-pyridinyl]-1,3-oxazole;2-[2-[2-(1,3-benzothiazol-2-yl)-6-(1,3-oxazol-2-yl)-1H-carbazol-1-id-9-yl]-4-pyridin-2-ylbenzene-3-id-1-yl]-1,3-oxazole;2-[2-(1,3-benzothiazol-2-yl)-6-(1,3-oxazol-2-yl)-9-(3-pyridin-2-ylbenzene-2-id-1-yl)-1H-carbazol-1-id-3-yl]-1,3-oxazole;tris(platinum(2+))
CID 160025967
1-methyl-2-propan-2-ylindole-5-carbonitrile;1-methyl-2-propan-2-ylindole-6-carbonitrile;1-methyl-2-propan-2-ylindole-5-carboxamide;1-methyl-2-propan-2-ylindole-6-carboxamide;2-methyl-5-(5-propan-2-ylthiophen-2-yl)-1,3-oxazole;2-propan-2-yl-1H-indole-5-carbonitrile;2-propan-2-yl-1H-indole-5-carboxamide;2-propan-2-yl-1H-indole-6-carboxamide;4-(5-propan-2-ylthiophen-2-yl)-1H-pyrazole;3-(5-propan-2-ylthiophen-2-yl)pyridine;4-(5-propan-2-ylthiophen-2-yl)pyridine
CID 160444670
1H-indol-3-yl-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(5-methyl-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(5-methyl-3-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(6-methyl-2-pyridinyl)-(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methanone;(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-pyridin-3-ylmethanone;(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-(3H-pyrrol-4-yl)methanone;(2-phenylmethoxy-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-thiophen-3-ylmethanone
CID 160553268
methyl 4-[[(2S,4R)-1-acetyl-2-methyl-6-(1-methylpyrazol-3-yl)-3,4-dihydro-2H-quinolin-4-yl]amino]benzoate;propan-2-yl N-[(2S,4R)-1-acetyl-6-(furan-2-yl)-2-methyl-3,4-dihydro-2H-quinolin-4-yl]carbamate;propan-2-yl N-[(2S,4R)-1-acetyl-6-(furan-3-yl)-2-methyl-3,4-dihydro-2H-quinolin-4-yl]carbamate;propan-2-yl N-[(2S,4R)-1-acetyl-2-methyl-6-(1H-pyrrol-3-yl)-3,4-dihydro-2H-quinolin-4-yl]carbamate;propan-2-yl N-[(2S,4R)-1-acetyl-2-methyl-6-thiophen-2-yl-3,4-dihydro-2H-quinolin-4-yl]carbamate
CID 160798194
N-[5-[9-(furan-3-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-methylphenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-pyridin-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-thiophen-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[3-[2-oxo-9-(1H-pyrazol-4-yl)benzo[h][1,6]naphthyridin-1-yl]phenyl]prop-2-enamide;1-(1-prop-2-enoyl-2,3-dihydroindol-6-yl)-9-quinolin-3-ylbenzo[h][1,6]naphthyridin-2-one
CID 160946439
5-(3-aminopropyl)-3-methyl-8-(1-methylpyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(2-methylpyrazol-3-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-2-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one
CID 160968228

Frequently Asked Questions

What is the IUPAC name of 5-(3-aminopropyl)-3-methyl-8-(2-methylpyrazol-3-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-2-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one?
The IUPAC name of 5-(3-aminopropyl)-3-methyl-8-(2-methylpyrazol-3-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-2-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one (CID 158633154) is 5-(3-aminopropyl)-3-methyl-8-(2-methylpyrazol-3-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-2-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one.
What is the SMILES notation for 5-(3-aminopropyl)-3-methyl-8-(2-methylpyrazol-3-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-2-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one?
The canonical SMILES for 5-(3-aminopropyl)-3-methyl-8-(2-methylpyrazol-3-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-2-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one is Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3cccs3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3ccn[nH]3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3ccnn3C)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3ccsc3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3cn[nH]c3)cc21.Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(-c3ncco3)cc21.
What is the InChIKey of 5-(3-aminopropyl)-3-methyl-8-(2-methylpyrazol-3-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-2-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one?
The InChIKey is HZLCURXSFWTQIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N6O.2C18H18N4OS.2C17H18N6O.C17H17N5O2/c1-11-16-17(22-21-11)13-10-12(14-6-8-20-23(14)2)4-5-15(13)24(18(16)25)9-3-7-19;1-11-16-17(21-20-11)14-9-12(13-5-8-24-10-13)3-4-15(14)22(18(16)23)7-2-6-19;1-11-16-17(21-20-11)13-10-12(15-4-2-9-24-15)5-6-14(13)22(18(16)23)8-3-7-19;1-10-15-16(22-20-10)12-9-11(13-5-7-19-21-13)3-4-14(12)23(17(15)24)8-2-6-18;1-10-15-16(22-21-10)13-7-11(12-8-19-20-9-12)3-4-14(13)23(17(15)24)6-2-5-18;1-10-14-15(21-20-10)12-9-11(16-19-6-8-24-16)3-4-13(12)22(17(14)23)7-2-5-18/h4-6,8,10H,3,7,9,19H2,1-2H3,(H,21,22);3-5,8-10H,2,6-7,19H2,1H3,(H,20,21);2,4-6,9-10H,3,7-8,19H2,1H3,(H,20,21);3-5,7,9H,2,6,8,18H2,1H3,(H,19,21)(H,20,22);3-4,7-9H,2,5-6,18H2,1H3,(H,19,20)(H,21,22);3-4,6,8-9H,2,5,7,18H2,1H3,(H,20,21).
What are the key properties of 5-(3-aminopropyl)-3-methyl-8-(2-methylpyrazol-3-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-2-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one?
5-(3-aminopropyl)-3-methyl-8-(2-methylpyrazol-3-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-2-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one has a molecular weight of 1981.37 g/mol, XLogP of 14.50, 24 rotatable bonds, 14 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-aminopropyl)-3-methyl-8-(2-methylpyrazol-3-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1,3-oxazol-2-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(1H-pyrazol-5-yl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-2-yl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-thiophen-3-yl-2H-pyrazolo[4,3-c]quinolin-4-one is sourced from PubChem (CID 158633154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).