2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-ethyl-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-(2-hydroxyethyl)-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-trimethylazanium;3-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]propyl-trimethylazanium;carbanide;2-(3-methylimidazol-3-ium-1-yl)pyrazolo[1,5-a]pyridin-3-amine

C67H113N25O — CID 157069911

IUPAC2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-ethyl-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-(2-hydroxyethyl)-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-trimethylazanium;3-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]propyl-trimethylazanium;carbanide;2-(3-methylimidazol-3-ium-1-yl)pyrazolo[1,5-a]pyridin-3-amine
SMILESCC[N+](C)(C)CCNc1nn2ccccc2c1N.C[N+](C)(C)CCCNc1nn2ccccc2c1N.C[N+](C)(C)CCNc1nn2ccccc2c1N.C[N+](C)(CCO)CCNc1nn2ccccc2c1N.C[n+]1ccn(-c2nn3ccccc3c2N)c1.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-]
InChIInChI=1S/C13H22N5O.2C13H22N5.C12H20N5.C11H12N5.5CH3/c1-18(2,9-10-19)8-6-15-13-12(14)11-5-3-4-7-17(11)16-13;1-18(2,3)10-6-8-15-13-12(14)11-7-4-5-9-17(11)16-13;1-4-18(2,3)10-8-15-13-12(14)11-7-5-6-9-17(11)16-13;1-17(2,3)9-7-14-12-11(13)10-6-4-5-8-16(10)15-12;1-14-6-7-15(8-14)11-10(12)9-4-2-3-5-16(9)13-11;;;;;/h3-5,7,19H,6,8-10,14H2,1-2H3,(H,15,16);4-5,7,9H,6,8,10,14H2,1-3H3,(H,15,16);5-7,9H,4,8,10,14H2,1-3H3,(H,15,16);4-6,8H,7,9,13H2,1-3H3,(H,14,15);2-8H,12H2,1H3;5*1H3/q5*+1;5*-1
InChIKeyACHONRNFTUCJQL-UHFFFAOYSA-N
MW1284.81 g/mol
LogP7.06
Rot. Bonds21

About 2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-ethyl-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-(2-hydroxyethyl)-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-trimethylazanium;3-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]propyl-trimethylazanium;carbanide;2-(3-methylimidazol-3-ium-1-yl)pyrazolo[1,5-a]pyridin-3-amine

2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-ethyl-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-(2-hydroxyethyl)-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-trimethylazanium;3-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]propyl-trimethylazanium;carbanide;2-(3-methylimidazol-3-ium-1-yl)pyrazolo[1,5-a]pyridin-3-amine (PubChem CID 157069911) has the molecular formula C67H113N25O and a molecular weight of 1284.81 g/mol. Its IUPAC name is 2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-ethyl-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-(2-hydroxyethyl)-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-trimethylazanium;3-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]propyl-trimethylazanium;carbanide;2-(3-methylimidazol-3-ium-1-yl)pyrazolo[1,5-a]pyridin-3-amine.

Molecular Properties

Compound Name2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-ethyl-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-(2-hydroxyethyl)-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-trimethylazanium;3-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]propyl-trimethylazanium;carbanide;2-(3-methylimidazol-3-ium-1-yl)pyrazolo[1,5-a]pyridin-3-amine
PubChem CID157069911
Molecular FormulaC67H113N25O
Molecular Weight1284.81 g/mol
Exact Mass1283.96
IUPAC Name2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-ethyl-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-(2-hydroxyethyl)-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-trimethylazanium;3-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]propyl-trimethylazanium;carbanide;2-(3-methylimidazol-3-ium-1-yl)pyrazolo[1,5-a]pyridin-3-amine
SMILESCC[N+](C)(C)CCNc1nn2ccccc2c1N.C[N+](C)(C)CCCNc1nn2ccccc2c1N.C[N+](C)(C)CCNc1nn2ccccc2c1N.C[N+](C)(CCO)CCNc1nn2ccccc2c1N.C[n+]1ccn(-c2nn3ccccc3c2N)c1.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-]
InChIInChI=1S/C13H22N5O.2C13H22N5.C12H20N5.C11H12N5.5CH3/c1-18(2,9-10-19)8-6-15-13-12(14)11-5-3-4-7-17(11)16-13;1-18(2,3)10-6-8-15-13-12(14)11-7-4-5-9-17(11)16-13;1-4-18(2,3)10-8-15-13-12(14)11-7-5-6-9-17(11)16-13;1-17(2,3)9-7-14-12-11(13)10-6-4-5-8-16(10)15-12;1-14-6-7-15(8-14)11-10(12)9-4-2-3-5-16(9)13-11;;;;;/h3-5,7,19H,6,8-10,14H2,1-2H3,(H,15,16);4-5,7,9H,6,8,10,14H2,1-3H3,(H,15,16);5-7,9H,4,8,10,14H2,1-3H3,(H,15,16);4-6,8H,7,9,13H2,1-3H3,(H,14,15);2-8H,12H2,1H3;5*1H3/q5*+1;5*-1
InChIKeyACHONRNFTUCJQL-UHFFFAOYSA-N
XLogP7.06
TPSA293.76 Ų
H-Bond Donors10
H-Bond Acceptors21
Rotatable Bonds21
Heavy Atoms93
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001284.81
LogP ≤ 57.06
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1021

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

Analyze 2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-ethyl-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-(2-hydroxyethyl)-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-trimethylazanium;3-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]propyl-trimethylazanium;carbanide;2-(3-methylimidazol-3-ium-1-yl)pyrazolo[1,5-a]pyridin-3-amine with MolForge

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Related Compounds

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US10336761, Example 259
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US9266891, III-38
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US9266891, III-41
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US9266891, III-22
CID 76072256
US9266891, III-24
CID 76072257
US9266891, III-27
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US9266891, III-29
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US9266891, III-30
CID 76072371
US10336761, Example 231
CID 126484416
2-[[6-[[6-(5-Amino-3-methylpyrazol-1-yl)-3-pyridinyl]methylamino]-9-ethylpurin-2-yl]amino]ethanol
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Frequently Asked Questions

What is the IUPAC name of 2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-ethyl-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-(2-hydroxyethyl)-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-trimethylazanium;3-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]propyl-trimethylazanium;carbanide;2-(3-methylimidazol-3-ium-1-yl)pyrazolo[1,5-a]pyridin-3-amine?
The IUPAC name of 2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-ethyl-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-(2-hydroxyethyl)-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-trimethylazanium;3-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]propyl-trimethylazanium;carbanide;2-(3-methylimidazol-3-ium-1-yl)pyrazolo[1,5-a]pyridin-3-amine (CID 157069911) is 2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-ethyl-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-(2-hydroxyethyl)-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-trimethylazanium;3-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]propyl-trimethylazanium;carbanide;2-(3-methylimidazol-3-ium-1-yl)pyrazolo[1,5-a]pyridin-3-amine.
What is the SMILES notation for 2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-ethyl-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-(2-hydroxyethyl)-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-trimethylazanium;3-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]propyl-trimethylazanium;carbanide;2-(3-methylimidazol-3-ium-1-yl)pyrazolo[1,5-a]pyridin-3-amine?
The canonical SMILES for 2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-ethyl-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-(2-hydroxyethyl)-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-trimethylazanium;3-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]propyl-trimethylazanium;carbanide;2-(3-methylimidazol-3-ium-1-yl)pyrazolo[1,5-a]pyridin-3-amine is CC[N+](C)(C)CCNc1nn2ccccc2c1N.C[N+](C)(C)CCCNc1nn2ccccc2c1N.C[N+](C)(C)CCNc1nn2ccccc2c1N.C[N+](C)(CCO)CCNc1nn2ccccc2c1N.C[n+]1ccn(-c2nn3ccccc3c2N)c1.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].
What is the InChIKey of 2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-ethyl-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-(2-hydroxyethyl)-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-trimethylazanium;3-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]propyl-trimethylazanium;carbanide;2-(3-methylimidazol-3-ium-1-yl)pyrazolo[1,5-a]pyridin-3-amine?
The InChIKey is ACHONRNFTUCJQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N5O.2C13H22N5.C12H20N5.C11H12N5.5CH3/c1-18(2,9-10-19)8-6-15-13-12(14)11-5-3-4-7-17(11)16-13;1-18(2,3)10-6-8-15-13-12(14)11-7-4-5-9-17(11)16-13;1-4-18(2,3)10-8-15-13-12(14)11-7-5-6-9-17(11)16-13;1-17(2,3)9-7-14-12-11(13)10-6-4-5-8-16(10)15-12;1-14-6-7-15(8-14)11-10(12)9-4-2-3-5-16(9)13-11;;;;;/h3-5,7,19H,6,8-10,14H2,1-2H3,(H,15,16);4-5,7,9H,6,8,10,14H2,1-3H3,(H,15,16);5-7,9H,4,8,10,14H2,1-3H3,(H,15,16);4-6,8H,7,9,13H2,1-3H3,(H,14,15);2-8H,12H2,1H3;5*1H3/q5*+1;5*-1.
What are the key properties of 2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-ethyl-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-(2-hydroxyethyl)-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-trimethylazanium;3-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]propyl-trimethylazanium;carbanide;2-(3-methylimidazol-3-ium-1-yl)pyrazolo[1,5-a]pyridin-3-amine?
2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-ethyl-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-(2-hydroxyethyl)-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-trimethylazanium;3-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]propyl-trimethylazanium;carbanide;2-(3-methylimidazol-3-ium-1-yl)pyrazolo[1,5-a]pyridin-3-amine has a molecular weight of 1284.81 g/mol, XLogP of 7.06, 21 rotatable bonds, 10 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-ethyl-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-(2-hydroxyethyl)-dimethylazanium;2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-trimethylazanium;3-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]propyl-trimethylazanium;carbanide;2-(3-methylimidazol-3-ium-1-yl)pyrazolo[1,5-a]pyridin-3-amine is sourced from PubChem (CID 157069911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).