1-amino-N-[3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propyl]cyclopropane-1-carboxamide;5-(3-aminopropyl)-3-(1-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(methoxymethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(3-methoxypropyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-4-oxo-2H-pyrazolo[4,3-c]quinoline-3-carboxamide

C80H96N22O10 — CID 159446674

IUPAC1-amino-N-[3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propyl]cyclopropane-1-carboxamide;5-(3-aminopropyl)-3-(1-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(methoxymethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(3-methoxypropyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-4-oxo-2H-pyrazolo[4,3-c]quinoline-3-carboxamide
SMILESCOC(C)c1[nH]nc2c1c(=O)n(CCCN)c1ccccc21.COCCCc1[nH]nc2c1c(=O)n(CCCN)c1ccccc21.COCc1[nH]nc2c1c(=O)n(CCCN)c1ccccc21.Cc1[nH]nc2c1c(=O)n(CCCNC(=O)C1(N)CC1)c1ccccc21.NCCCn1c(=O)c2c(C(N)=O)[nH]nc2c2ccccc21
InChIInChI=1S/C18H21N5O2.C17H22N4O2.C16H20N4O2.C15H18N4O2.C14H15N5O2/c1-11-14-15(22-21-11)12-5-2-3-6-13(12)23(16(14)24)10-4-9-20-17(25)18(19)7-8-18;1-23-11-4-7-13-15-16(20-19-13)12-6-2-3-8-14(12)21(17(15)22)10-5-9-18;1-10(22-2)14-13-15(19-18-14)11-6-3-4-7-12(11)20(16(13)21)9-5-8-17;1-21-9-11-13-14(18-17-11)10-5-2-3-6-12(10)19(15(13)20)8-4-7-16;15-6-3-7-19-9-5-2-1-4-8(9)11-10(14(19)21)12(13(16)20)18-17-11/h2-3,5-6H,4,7-10,19H2,1H3,(H,20,25)(H,21,22);2-3,6,8H,4-5,7,9-11,18H2,1H3,(H,19,20);3-4,6-7,10H,5,8-9,17H2,1-2H3,(H,18,19);2-3,5-6H,4,7-9,16H2,1H3,(H,17,18);1-2,4-5H,3,6-7,15H2,(H2,16,20)(H,17,18)
InChIKeyLSVPXJFUOXWNPK-UHFFFAOYSA-N
MW1525.79 g/mol
LogP6.62
Rot. Bonds26

About 1-amino-N-[3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propyl]cyclopropane-1-carboxamide;5-(3-aminopropyl)-3-(1-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(methoxymethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(3-methoxypropyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-4-oxo-2H-pyrazolo[4,3-c]quinoline-3-carboxamide

1-amino-N-[3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propyl]cyclopropane-1-carboxamide;5-(3-aminopropyl)-3-(1-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(methoxymethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(3-methoxypropyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-4-oxo-2H-pyrazolo[4,3-c]quinoline-3-carboxamide (PubChem CID 159446674) has the molecular formula C80H96N22O10 and a molecular weight of 1525.79 g/mol. Its IUPAC name is 1-amino-N-[3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propyl]cyclopropane-1-carboxamide;5-(3-aminopropyl)-3-(1-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(methoxymethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(3-methoxypropyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-4-oxo-2H-pyrazolo[4,3-c]quinoline-3-carboxamide.

Molecular Properties

Compound Name1-amino-N-[3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propyl]cyclopropane-1-carboxamide;5-(3-aminopropyl)-3-(1-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(methoxymethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(3-methoxypropyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-4-oxo-2H-pyrazolo[4,3-c]quinoline-3-carboxamide
PubChem CID159446674
Molecular FormulaC80H96N22O10
Molecular Weight1525.79 g/mol
Exact Mass1524.77
IUPAC Name1-amino-N-[3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propyl]cyclopropane-1-carboxamide;5-(3-aminopropyl)-3-(1-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(methoxymethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(3-methoxypropyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-4-oxo-2H-pyrazolo[4,3-c]quinoline-3-carboxamide
SMILESCOC(C)c1[nH]nc2c1c(=O)n(CCCN)c1ccccc21.COCCCc1[nH]nc2c1c(=O)n(CCCN)c1ccccc21.COCc1[nH]nc2c1c(=O)n(CCCN)c1ccccc21.Cc1[nH]nc2c1c(=O)n(CCCNC(=O)C1(N)CC1)c1ccccc21.NCCCn1c(=O)c2c(C(N)=O)[nH]nc2c2ccccc21
InChIInChI=1S/C18H21N5O2.C17H22N4O2.C16H20N4O2.C15H18N4O2.C14H15N5O2/c1-11-14-15(22-21-11)12-5-2-3-6-13(12)23(16(14)24)10-4-9-20-17(25)18(19)7-8-18;1-23-11-4-7-13-15-16(20-19-13)12-6-2-3-8-14(12)21(17(15)22)10-5-9-18;1-10(22-2)14-13-15(19-18-14)11-6-3-4-7-12(11)20(16(13)21)9-5-8-17;1-21-9-11-13-14(18-17-11)10-5-2-3-6-12(10)19(15(13)20)8-4-7-16;15-6-3-7-19-9-5-2-1-4-8(9)11-10(14(19)21)12(13(16)20)18-17-11/h2-3,5-6H,4,7-10,19H2,1H3,(H,20,25)(H,21,22);2-3,6,8H,4-5,7,9-11,18H2,1H3,(H,19,20);3-4,6-7,10H,5,8-9,17H2,1-2H3,(H,18,19);2-3,5-6H,4,7-9,16H2,1H3,(H,17,18);1-2,4-5H,3,6-7,15H2,(H2,16,20)(H,17,18)
InChIKeyLSVPXJFUOXWNPK-UHFFFAOYSA-N
XLogP6.62
TPSA483.38 Ų
H-Bond Donors12
H-Bond Acceptors25
Rotatable Bonds26
Heavy Atoms112
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001525.79
LogP ≤ 56.62
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

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

Analyze 1-amino-N-[3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propyl]cyclopropane-1-carboxamide;5-(3-aminopropyl)-3-(1-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(methoxymethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(3-methoxypropyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-4-oxo-2H-pyrazolo[4,3-c]quinoline-3-carboxamide with MolForge

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Related Compounds

(6,6-dimethyl-4,7-dihydro-1H-pyrano[4,3-c]pyrazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(1-methyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-methylidene-1,4,6,7-tetrahydropyrazolo[5,4-c]pyridin-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-methyl-6-methylidene-4,7-dihydro-1H-pyrazolo[4,3-c]pyridin-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(1-methyl-4,5,6,7-tetrahydroindazol-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;6-methyl-3-[4-[2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-4,7-dihydro-1H-pyrazolo[5,4-c]pyridin-5-one;3-[4-[2-(trifluoromethyl)phenyl]piperidine-1-carbonyl]-1,4,5,7-tetrahydropyrazolo[4,3-c]pyridin-6-one;[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]-(1,6,6-trimethyl-4,7-dihydropyrano[4,3-c]pyrazol-3-yl)methanone
CID 163963647
1-methyl-N-[3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propyl]piperidine-4-carboxamide;3-methyl-5-(morpholin-2-ylmethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;N-[3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propyl]oxane-4-carboxamide;N-[3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propyl]piperidine-3-carboxamide;3-methyl-5-(piperidin-4-ylmethyl)-2H-pyrazolo[4,3-c]quinolin-4-one
CID 157999491
8-(aminomethoxy)-5-(3-aminopropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;8-(3-aminopropoxy)-5-(3-aminopropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-(2-methylpropoxy)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-phenylmethoxy-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-8-propoxy-2H-pyrazolo[4,3-c]quinolin-4-one
CID 159635511
5-(3-aminopropyl)-8-methoxy-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[3-(benzylamino)propyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;N-benzyl-3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propanamide;3-methyl-5-(3-phenylmethoxypropyl)-2H-pyrazolo[4,3-c]quinolin-4-one
CID 160486094
N-[1-amino-3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propan-2-yl]benzamide;5-[2-amino-4-(4-methylpiperazin-1-yl)-4-oxobutyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-[3-amino-4-(4-methylpiperazin-1-yl)-4-oxobutyl]-3-methyl-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-[[1-(methoxymethyl)cyclopropyl]methyl]-2H-pyrazolo[4,3-c]quinolin-4-one;2-[5-(3-aminopropyl)-4-oxo-2H-pyrazolo[4,3-c]quinolin-3-yl]-2-methylpropanenitrile
CID 162155062

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propyl]cyclopropane-1-carboxamide;5-(3-aminopropyl)-3-(1-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(methoxymethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(3-methoxypropyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-4-oxo-2H-pyrazolo[4,3-c]quinoline-3-carboxamide?
The IUPAC name of 1-amino-N-[3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propyl]cyclopropane-1-carboxamide;5-(3-aminopropyl)-3-(1-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(methoxymethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(3-methoxypropyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-4-oxo-2H-pyrazolo[4,3-c]quinoline-3-carboxamide (CID 159446674) is 1-amino-N-[3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propyl]cyclopropane-1-carboxamide;5-(3-aminopropyl)-3-(1-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(methoxymethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(3-methoxypropyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-4-oxo-2H-pyrazolo[4,3-c]quinoline-3-carboxamide.
What is the SMILES notation for 1-amino-N-[3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propyl]cyclopropane-1-carboxamide;5-(3-aminopropyl)-3-(1-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(methoxymethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(3-methoxypropyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-4-oxo-2H-pyrazolo[4,3-c]quinoline-3-carboxamide?
The canonical SMILES for 1-amino-N-[3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propyl]cyclopropane-1-carboxamide;5-(3-aminopropyl)-3-(1-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(methoxymethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(3-methoxypropyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-4-oxo-2H-pyrazolo[4,3-c]quinoline-3-carboxamide is COC(C)c1[nH]nc2c1c(=O)n(CCCN)c1ccccc21.COCCCc1[nH]nc2c1c(=O)n(CCCN)c1ccccc21.COCc1[nH]nc2c1c(=O)n(CCCN)c1ccccc21.Cc1[nH]nc2c1c(=O)n(CCCNC(=O)C1(N)CC1)c1ccccc21.NCCCn1c(=O)c2c(C(N)=O)[nH]nc2c2ccccc21.
What is the InChIKey of 1-amino-N-[3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propyl]cyclopropane-1-carboxamide;5-(3-aminopropyl)-3-(1-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(methoxymethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(3-methoxypropyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-4-oxo-2H-pyrazolo[4,3-c]quinoline-3-carboxamide?
The InChIKey is LSVPXJFUOXWNPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N5O2.C17H22N4O2.C16H20N4O2.C15H18N4O2.C14H15N5O2/c1-11-14-15(22-21-11)12-5-2-3-6-13(12)23(16(14)24)10-4-9-20-17(25)18(19)7-8-18;1-23-11-4-7-13-15-16(20-19-13)12-6-2-3-8-14(12)21(17(15)22)10-5-9-18;1-10(22-2)14-13-15(19-18-14)11-6-3-4-7-12(11)20(16(13)21)9-5-8-17;1-21-9-11-13-14(18-17-11)10-5-2-3-6-12(10)19(15(13)20)8-4-7-16;15-6-3-7-19-9-5-2-1-4-8(9)11-10(14(19)21)12(13(16)20)18-17-11/h2-3,5-6H,4,7-10,19H2,1H3,(H,20,25)(H,21,22);2-3,6,8H,4-5,7,9-11,18H2,1H3,(H,19,20);3-4,6-7,10H,5,8-9,17H2,1-2H3,(H,18,19);2-3,5-6H,4,7-9,16H2,1H3,(H,17,18);1-2,4-5H,3,6-7,15H2,(H2,16,20)(H,17,18).
What are the key properties of 1-amino-N-[3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propyl]cyclopropane-1-carboxamide;5-(3-aminopropyl)-3-(1-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(methoxymethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(3-methoxypropyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-4-oxo-2H-pyrazolo[4,3-c]quinoline-3-carboxamide?
1-amino-N-[3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propyl]cyclopropane-1-carboxamide;5-(3-aminopropyl)-3-(1-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(methoxymethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(3-methoxypropyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-4-oxo-2H-pyrazolo[4,3-c]quinoline-3-carboxamide has a molecular weight of 1525.79 g/mol, XLogP of 6.62, 26 rotatable bonds, 12 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propyl]cyclopropane-1-carboxamide;5-(3-aminopropyl)-3-(1-methoxyethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(methoxymethyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-3-(3-methoxypropyl)-2H-pyrazolo[4,3-c]quinolin-4-one;5-(3-aminopropyl)-4-oxo-2H-pyrazolo[4,3-c]quinoline-3-carboxamide is sourced from PubChem (CID 159446674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).