2-[[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]methyl]butan-1-ol;2-[(1-ethylcyclopropyl)methyl]-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(3-methylcyclopentyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(2-propoxyethyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine

C74H80N24O2 — CID 158494766

IUPAC2-[[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]methyl]butan-1-ol;2-[(1-ethylcyclopropyl)methyl]-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(3-methylcyclopentyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(2-propoxyethyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine
SMILESCC1CCC(n2cc3c(N)nc4cc(-c5ccn[nH]5)ccc4c3n2)C1.CCC(CO)Cn1cc2c(N)nc3cc(-c4ccn[nH]4)ccc3c2n1.CCC1(Cn2cc3c(N)nc4cc(-c5ccn[nH]5)ccc4c3n2)CC1.CCCOCCn1cc2c(N)nc3cc(-c4ccn[nH]4)ccc3c2n1
InChIInChI=1S/2C19H20N6.2C18H20N6O/c1-11-2-4-13(8-11)25-10-15-18(24-25)14-5-3-12(16-6-7-21-23-16)9-17(14)22-19(15)20;1-2-19(6-7-19)11-25-10-14-17(24-25)13-4-3-12(15-5-8-21-23-15)9-16(13)22-18(14)20;1-2-11(10-25)8-24-9-14-17(23-24)13-4-3-12(15-5-6-20-22-15)7-16(13)21-18(14)19;1-2-8-25-9-7-24-11-14-17(23-24)13-4-3-12(15-5-6-20-22-15)10-16(13)21-18(14)19/h3,5-7,9-11,13H,2,4,8H2,1H3,(H2,20,22)(H,21,23);3-5,8-10H,2,6-7,11H2,1H3,(H2,20,22)(H,21,23);3-7,9,11,25H,2,8,10H2,1H3,(H2,19,21)(H,20,22);3-6,10-11H,2,7-9H2,1H3,(H2,19,21)(H,20,22)
InChIKeyHJDIIQZWFFHBOF-UHFFFAOYSA-N
MW1337.62 g/mol
LogP13.22
Rot. Bonds17

About 2-[[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]methyl]butan-1-ol;2-[(1-ethylcyclopropyl)methyl]-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(3-methylcyclopentyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(2-propoxyethyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine

2-[[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]methyl]butan-1-ol;2-[(1-ethylcyclopropyl)methyl]-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(3-methylcyclopentyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(2-propoxyethyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine (PubChem CID 158494766) has the molecular formula C74H80N24O2 and a molecular weight of 1337.62 g/mol. Its IUPAC name is 2-[[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]methyl]butan-1-ol;2-[(1-ethylcyclopropyl)methyl]-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(3-methylcyclopentyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(2-propoxyethyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine.

Molecular Properties

Compound Name2-[[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]methyl]butan-1-ol;2-[(1-ethylcyclopropyl)methyl]-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(3-methylcyclopentyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(2-propoxyethyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine
PubChem CID158494766
Molecular FormulaC74H80N24O2
Molecular Weight1337.62 g/mol
Exact Mass1336.69
IUPAC Name2-[[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]methyl]butan-1-ol;2-[(1-ethylcyclopropyl)methyl]-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(3-methylcyclopentyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(2-propoxyethyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine
SMILESCC1CCC(n2cc3c(N)nc4cc(-c5ccn[nH]5)ccc4c3n2)C1.CCC(CO)Cn1cc2c(N)nc3cc(-c4ccn[nH]4)ccc3c2n1.CCC1(Cn2cc3c(N)nc4cc(-c5ccn[nH]5)ccc4c3n2)CC1.CCCOCCn1cc2c(N)nc3cc(-c4ccn[nH]4)ccc3c2n1
InChIInChI=1S/2C19H20N6.2C18H20N6O/c1-11-2-4-13(8-11)25-10-15-18(24-25)14-5-3-12(16-6-7-21-23-16)9-17(14)22-19(15)20;1-2-19(6-7-19)11-25-10-14-17(24-25)13-4-3-12(15-5-8-21-23-15)9-16(13)22-18(14)20;1-2-11(10-25)8-24-9-14-17(23-24)13-4-3-12(15-5-6-20-22-15)7-16(13)21-18(14)19;1-2-8-25-9-7-24-11-14-17(23-24)13-4-3-12(15-5-6-20-22-15)10-16(13)21-18(14)19/h3,5-7,9-11,13H,2,4,8H2,1H3,(H2,20,22)(H,21,23);3-5,8-10H,2,6-7,11H2,1H3,(H2,20,22)(H,21,23);3-7,9,11,25H,2,8,10H2,1H3,(H2,19,21)(H,20,22);3-6,10-11H,2,7-9H2,1H3,(H2,19,21)(H,20,22)
InChIKeyHJDIIQZWFFHBOF-UHFFFAOYSA-N
XLogP13.22
TPSA371.10 Ų
H-Bond Donors9
H-Bond Acceptors22
Rotatable Bonds17
Heavy Atoms100
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001337.62
LogP ≤ 513.22
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

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

Analyze 2-[[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]methyl]butan-1-ol;2-[(1-ethylcyclopropyl)methyl]-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(3-methylcyclopentyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(2-propoxyethyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]methyl]butan-1-ol;2-[(1-ethylcyclopropyl)methyl]-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(3-methylcyclopentyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(2-propoxyethyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine?
The IUPAC name of 2-[[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]methyl]butan-1-ol;2-[(1-ethylcyclopropyl)methyl]-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(3-methylcyclopentyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(2-propoxyethyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine (CID 158494766) is 2-[[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]methyl]butan-1-ol;2-[(1-ethylcyclopropyl)methyl]-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(3-methylcyclopentyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(2-propoxyethyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine.
What is the SMILES notation for 2-[[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]methyl]butan-1-ol;2-[(1-ethylcyclopropyl)methyl]-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(3-methylcyclopentyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(2-propoxyethyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine?
The canonical SMILES for 2-[[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]methyl]butan-1-ol;2-[(1-ethylcyclopropyl)methyl]-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(3-methylcyclopentyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(2-propoxyethyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine is CC1CCC(n2cc3c(N)nc4cc(-c5ccn[nH]5)ccc4c3n2)C1.CCC(CO)Cn1cc2c(N)nc3cc(-c4ccn[nH]4)ccc3c2n1.CCC1(Cn2cc3c(N)nc4cc(-c5ccn[nH]5)ccc4c3n2)CC1.CCCOCCn1cc2c(N)nc3cc(-c4ccn[nH]4)ccc3c2n1.
What is the InChIKey of 2-[[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]methyl]butan-1-ol;2-[(1-ethylcyclopropyl)methyl]-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(3-methylcyclopentyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(2-propoxyethyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine?
The InChIKey is HJDIIQZWFFHBOF-UHFFFAOYSA-N. The full InChI is InChI=1S/2C19H20N6.2C18H20N6O/c1-11-2-4-13(8-11)25-10-15-18(24-25)14-5-3-12(16-6-7-21-23-16)9-17(14)22-19(15)20;1-2-19(6-7-19)11-25-10-14-17(24-25)13-4-3-12(15-5-8-21-23-15)9-16(13)22-18(14)20;1-2-11(10-25)8-24-9-14-17(23-24)13-4-3-12(15-5-6-20-22-15)7-16(13)21-18(14)19;1-2-8-25-9-7-24-11-14-17(23-24)13-4-3-12(15-5-6-20-22-15)10-16(13)21-18(14)19/h3,5-7,9-11,13H,2,4,8H2,1H3,(H2,20,22)(H,21,23);3-5,8-10H,2,6-7,11H2,1H3,(H2,20,22)(H,21,23);3-7,9,11,25H,2,8,10H2,1H3,(H2,19,21)(H,20,22);3-6,10-11H,2,7-9H2,1H3,(H2,19,21)(H,20,22).
What are the key properties of 2-[[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]methyl]butan-1-ol;2-[(1-ethylcyclopropyl)methyl]-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(3-methylcyclopentyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(2-propoxyethyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine?
2-[[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]methyl]butan-1-ol;2-[(1-ethylcyclopropyl)methyl]-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(3-methylcyclopentyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(2-propoxyethyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine has a molecular weight of 1337.62 g/mol, XLogP of 13.22, 17 rotatable bonds, 9 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-amino-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-2-yl]methyl]butan-1-ol;2-[(1-ethylcyclopropyl)methyl]-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(3-methylcyclopentyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine;2-(2-propoxyethyl)-7-(1H-pyrazol-5-yl)pyrazolo[4,3-c]quinolin-4-amine is sourced from PubChem (CID 158494766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).