6-[(2-methylpropan-2-yl)oxy]pyridine-2-carboximidamide

C10H15N3O — CID 64594601

IUPAC6-[(2-methylpropan-2-yl)oxy]pyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1cccc(OC(C)(C)C)n1
InChIInChI=1S/C10H15N3O/c1-10(2,3)14-8-6-4-5-7(13-8)9(11)12/h4-6H,1-3H3,(H3,11,12)
InChIKeyUUARTASDWZPQIK-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.54
Rot. Bonds2

About 6-[(2-methylpropan-2-yl)oxy]pyridine-2-carboximidamide

6-[(2-methylpropan-2-yl)oxy]pyridine-2-carboximidamide (PubChem CID 64594601) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 6-[(2-methylpropan-2-yl)oxy]pyridine-2-carboximidamide.

Molecular Properties

Compound Name6-[(2-methylpropan-2-yl)oxy]pyridine-2-carboximidamide
PubChem CID64594601
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name6-[(2-methylpropan-2-yl)oxy]pyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1cccc(OC(C)(C)C)n1
InChIInChI=1S/C10H15N3O/c1-10(2,3)14-8-6-4-5-7(13-8)9(11)12/h4-6H,1-3H3,(H3,11,12)
InChIKeyUUARTASDWZPQIK-UHFFFAOYSA-N
XLogP1.54
TPSA71.99 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-[(2-methylpropan-2-yl)oxy]pyridine-2-carboximidamide?
The IUPAC name of 6-[(2-methylpropan-2-yl)oxy]pyridine-2-carboximidamide (CID 64594601) is 6-[(2-methylpropan-2-yl)oxy]pyridine-2-carboximidamide.
What is the SMILES notation for 6-[(2-methylpropan-2-yl)oxy]pyridine-2-carboximidamide?
The canonical SMILES for 6-[(2-methylpropan-2-yl)oxy]pyridine-2-carboximidamide is [H]/N=C(\N)c1cccc(OC(C)(C)C)n1.
What is the InChIKey of 6-[(2-methylpropan-2-yl)oxy]pyridine-2-carboximidamide?
The InChIKey is UUARTASDWZPQIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-10(2,3)14-8-6-4-5-7(13-8)9(11)12/h4-6H,1-3H3,(H3,11,12).
What are the key properties of 6-[(2-methylpropan-2-yl)oxy]pyridine-2-carboximidamide?
6-[(2-methylpropan-2-yl)oxy]pyridine-2-carboximidamide has a molecular weight of 193.25 g/mol, XLogP of 1.54, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-methylpropan-2-yl)oxy]pyridine-2-carboximidamide is sourced from PubChem (CID 64594601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).