2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboximidamide

C10H13N5 — CID 83881571

IUPAC2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboximidamide
SMILES[H]/N=C(\N)c1ccn2nc(C(C)C)nc2c1
InChIInChI=1S/C10H13N5/c1-6(2)10-13-8-5-7(9(11)12)3-4-15(8)14-10/h3-6H,1-2H3,(H3,11,12)
InChIKeyIUJYNJSJQZINEK-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.14
Rot. Bonds2

About 2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboximidamide

2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboximidamide (PubChem CID 83881571) has the molecular formula C10H13N5 and a molecular weight of 203.25 g/mol. Its IUPAC name is 2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboximidamide.

Molecular Properties

Compound Name2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboximidamide
PubChem CID83881571
Molecular FormulaC10H13N5
Molecular Weight203.25 g/mol
Exact Mass203.12
IUPAC Name2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboximidamide
SMILES[H]/N=C(\N)c1ccn2nc(C(C)C)nc2c1
InChIInChI=1S/C10H13N5/c1-6(2)10-13-8-5-7(9(11)12)3-4-15(8)14-10/h3-6H,1-2H3,(H3,11,12)
InChIKeyIUJYNJSJQZINEK-UHFFFAOYSA-N
XLogP1.14
TPSA80.06 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

methyl 2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate
CID 117135307
1-(2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)ethanamine
CID 83832634
6-propan-2-ylnaphthalene-2-carboximidamide
CID 138525860
2-(7-carbamimidoylnaphthalen-2-yl)propanoic acid
CID 140981325
3-bromo-4-(3,5-dimethyl-1,2,4-triazol-1-yl)benzenecarboximidamide
CID 82799867
7,8-dimethylbicyclo[4.2.0]octa-1(6),2,4-triene-3-carboximidamide
CID 20814090
6,7-dibromonaphthalene-2-carboximidamide
CID 121232083
3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-5-carboximidamide
CID 83881581
7-[3-(4-carbamimidoylphenyl)phenyl]naphthalene-2-carboximidamide
CID 164611720
6,7-dibromonaphthalene-2-carboximidamide;hydrochloride
CID 121232084
3-[7-(3-carbamimidoylphenyl)naphthalen-2-yl]benzenecarboximidamide
CID 10338813
1-[(5-carbamimidoylbenzimidazol-1-yl)methyl]benzimidazole-5-carboximidamide;zinc
CID 87650974

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboximidamide?
The IUPAC name of 2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboximidamide (CID 83881571) is 2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboximidamide.
What is the SMILES notation for 2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboximidamide?
The canonical SMILES for 2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboximidamide is [H]/N=C(\N)c1ccn2nc(C(C)C)nc2c1.
What is the InChIKey of 2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboximidamide?
The InChIKey is IUJYNJSJQZINEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5/c1-6(2)10-13-8-5-7(9(11)12)3-4-15(8)14-10/h3-6H,1-2H3,(H3,11,12).
What are the key properties of 2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboximidamide?
2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboximidamide has a molecular weight of 203.25 g/mol, XLogP of 1.14, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboximidamide is sourced from PubChem (CID 83881571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).