2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-methyl-di(propan-2-yl)azanium;2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-trimethylazanium;carbanide;6,7-dimethyl-2-[2-(4-methylmorpholin-4-ium-4-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine

C86H146N20O6 — CID 160788929

IUPAC2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-methyl-di(propan-2-yl)azanium;2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-trimethylazanium;carbanide;6,7-dimethyl-2-[2-(4-methylmorpholin-4-ium-4-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine
SMILESCc1ccc2c(N)c(OCC[N+](C)(C(C)C)C(C)C)nn2c1C.Cc1ccc2c(N)c(OCC[N+](C)(C)C)nn2c1C.Cc1ccc2c(N)c(OCC[N+]3(C)CCCC3)nn2c1C.Cc1ccc2c(N)c(OCC[N+]3(C)CCCCC3)nn2c1C.Cc1ccc2c(N)c(OCC[N+]3(C)CCOCC3)nn2c1C.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-]
InChIInChI=1S/C18H31N4O.C17H27N4O.C16H25N4O2.C16H25N4O.C14H23N4O.5CH3/c1-12(2)22(7,13(3)4)10-11-23-18-17(19)16-9-8-14(5)15(6)21(16)20-18;1-13-7-8-15-16(18)17(19-20(15)14(13)2)22-12-11-21(3)9-5-4-6-10-21;1-12-4-5-14-15(17)16(18-19(14)13(12)2)22-11-8-20(3)6-9-21-10-7-20;1-12-6-7-14-15(17)16(18-19(14)13(12)2)21-11-10-20(3)8-4-5-9-20;1-10-6-7-12-13(15)14(16-17(12)11(10)2)19-9-8-18(3,4)5;;;;;/h8-9,12-13H,10-11,19H2,1-7H3;7-8H,4-6,9-12,18H2,1-3H3;4-5H,6-11,17H2,1-3H3;6-7H,4-5,8-11,17H2,1-3H3;6-7H,8-9,15H2,1-5H3;5*1H3/q5*+1;5*-1
InChIKeySBOWBHGEOSQSQI-UHFFFAOYSA-N
MW1556.25 g/mol
LogP13.13
Rot. Bonds22

About 2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-methyl-di(propan-2-yl)azanium;2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-trimethylazanium;carbanide;6,7-dimethyl-2-[2-(4-methylmorpholin-4-ium-4-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine

2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-methyl-di(propan-2-yl)azanium;2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-trimethylazanium;carbanide;6,7-dimethyl-2-[2-(4-methylmorpholin-4-ium-4-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine (PubChem CID 160788929) has the molecular formula C86H146N20O6 and a molecular weight of 1556.25 g/mol. Its IUPAC name is 2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-methyl-di(propan-2-yl)azanium;2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-trimethylazanium;carbanide;6,7-dimethyl-2-[2-(4-methylmorpholin-4-ium-4-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine.

Molecular Properties

Compound Name2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-methyl-di(propan-2-yl)azanium;2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-trimethylazanium;carbanide;6,7-dimethyl-2-[2-(4-methylmorpholin-4-ium-4-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine
PubChem CID160788929
Molecular FormulaC86H146N20O6
Molecular Weight1556.25 g/mol
Exact Mass1555.17
IUPAC Name2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-methyl-di(propan-2-yl)azanium;2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-trimethylazanium;carbanide;6,7-dimethyl-2-[2-(4-methylmorpholin-4-ium-4-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine
SMILESCc1ccc2c(N)c(OCC[N+](C)(C(C)C)C(C)C)nn2c1C.Cc1ccc2c(N)c(OCC[N+](C)(C)C)nn2c1C.Cc1ccc2c(N)c(OCC[N+]3(C)CCCC3)nn2c1C.Cc1ccc2c(N)c(OCC[N+]3(C)CCCCC3)nn2c1C.Cc1ccc2c(N)c(OCC[N+]3(C)CCOCC3)nn2c1C.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-]
InChIInChI=1S/C18H31N4O.C17H27N4O.C16H25N4O2.C16H25N4O.C14H23N4O.5CH3/c1-12(2)22(7,13(3)4)10-11-23-18-17(19)16-9-8-14(5)15(6)21(16)20-18;1-13-7-8-15-16(18)17(19-20(15)14(13)2)22-12-11-21(3)9-5-4-6-10-21;1-12-4-5-14-15(17)16(18-19(14)13(12)2)22-11-8-20(3)6-9-21-10-7-20;1-12-6-7-14-15(17)16(18-19(14)13(12)2)21-11-10-20(3)8-4-5-9-20;1-10-6-7-12-13(15)14(16-17(12)11(10)2)19-9-8-18(3,4)5;;;;;/h8-9,12-13H,10-11,19H2,1-7H3;7-8H,4-6,9-12,18H2,1-3H3;4-5H,6-11,17H2,1-3H3;6-7H,4-5,8-11,17H2,1-3H3;6-7H,8-9,15H2,1-5H3;5*1H3/q5*+1;5*-1
InChIKeySBOWBHGEOSQSQI-UHFFFAOYSA-N
XLogP13.13
TPSA271.98 Ų
H-Bond Donors5
H-Bond Acceptors21
Rotatable Bonds22
Heavy Atoms112
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001556.25
LogP ≤ 513.13
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1021

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

Analyze 2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-methyl-di(propan-2-yl)azanium;2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-trimethylazanium;carbanide;6,7-dimethyl-2-[2-(4-methylmorpholin-4-ium-4-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-methyl-di(propan-2-yl)azanium;2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-trimethylazanium;carbanide;6,7-dimethyl-2-[2-(4-methylmorpholin-4-ium-4-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine?
The IUPAC name of 2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-methyl-di(propan-2-yl)azanium;2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-trimethylazanium;carbanide;6,7-dimethyl-2-[2-(4-methylmorpholin-4-ium-4-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine (CID 160788929) is 2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-methyl-di(propan-2-yl)azanium;2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-trimethylazanium;carbanide;6,7-dimethyl-2-[2-(4-methylmorpholin-4-ium-4-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine.
What is the SMILES notation for 2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-methyl-di(propan-2-yl)azanium;2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-trimethylazanium;carbanide;6,7-dimethyl-2-[2-(4-methylmorpholin-4-ium-4-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine?
The canonical SMILES for 2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-methyl-di(propan-2-yl)azanium;2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-trimethylazanium;carbanide;6,7-dimethyl-2-[2-(4-methylmorpholin-4-ium-4-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine is Cc1ccc2c(N)c(OCC[N+](C)(C(C)C)C(C)C)nn2c1C.Cc1ccc2c(N)c(OCC[N+](C)(C)C)nn2c1C.Cc1ccc2c(N)c(OCC[N+]3(C)CCCC3)nn2c1C.Cc1ccc2c(N)c(OCC[N+]3(C)CCCCC3)nn2c1C.Cc1ccc2c(N)c(OCC[N+]3(C)CCOCC3)nn2c1C.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].
What is the InChIKey of 2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-methyl-di(propan-2-yl)azanium;2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-trimethylazanium;carbanide;6,7-dimethyl-2-[2-(4-methylmorpholin-4-ium-4-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine?
The InChIKey is SBOWBHGEOSQSQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31N4O.C17H27N4O.C16H25N4O2.C16H25N4O.C14H23N4O.5CH3/c1-12(2)22(7,13(3)4)10-11-23-18-17(19)16-9-8-14(5)15(6)21(16)20-18;1-13-7-8-15-16(18)17(19-20(15)14(13)2)22-12-11-21(3)9-5-4-6-10-21;1-12-4-5-14-15(17)16(18-19(14)13(12)2)22-11-8-20(3)6-9-21-10-7-20;1-12-6-7-14-15(17)16(18-19(14)13(12)2)21-11-10-20(3)8-4-5-9-20;1-10-6-7-12-13(15)14(16-17(12)11(10)2)19-9-8-18(3,4)5;;;;;/h8-9,12-13H,10-11,19H2,1-7H3;7-8H,4-6,9-12,18H2,1-3H3;4-5H,6-11,17H2,1-3H3;6-7H,4-5,8-11,17H2,1-3H3;6-7H,8-9,15H2,1-5H3;5*1H3/q5*+1;5*-1.
What are the key properties of 2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-methyl-di(propan-2-yl)azanium;2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-trimethylazanium;carbanide;6,7-dimethyl-2-[2-(4-methylmorpholin-4-ium-4-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine?
2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-methyl-di(propan-2-yl)azanium;2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-trimethylazanium;carbanide;6,7-dimethyl-2-[2-(4-methylmorpholin-4-ium-4-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine has a molecular weight of 1556.25 g/mol, XLogP of 13.13, 22 rotatable bonds, 5 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-methyl-di(propan-2-yl)azanium;2-(3-amino-6,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)oxyethyl-trimethylazanium;carbanide;6,7-dimethyl-2-[2-(4-methylmorpholin-4-ium-4-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine;6,7-dimethyl-2-[2-(1-methylpyrrolidin-1-ium-1-yl)ethoxy]pyrazolo[1,5-a]pyridin-3-amine is sourced from PubChem (CID 160788929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).