2-(2-methylphenoxy)pyridine-3-carboximidamide

C13H13N3O — CID 24707903

IUPAC2-(2-methylphenoxy)pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1cccnc1Oc1ccccc1C
InChIInChI=1S/C13H13N3O/c1-9-5-2-3-7-11(9)17-13-10(12(14)15)6-4-8-16-13/h2-8H,1H3,(H3,14,15)
InChIKeyFHYQPFPHQIVOBL-UHFFFAOYSA-N
MW227.27 g/mol
LogP2.47
Rot. Bonds3

About 2-(2-methylphenoxy)pyridine-3-carboximidamide

2-(2-methylphenoxy)pyridine-3-carboximidamide (PubChem CID 24707903) has the molecular formula C13H13N3O and a molecular weight of 227.27 g/mol. Its IUPAC name is 2-(2-methylphenoxy)pyridine-3-carboximidamide.

Molecular Properties

Compound Name2-(2-methylphenoxy)pyridine-3-carboximidamide
PubChem CID24707903
Molecular FormulaC13H13N3O
Molecular Weight227.27 g/mol
Exact Mass227.11
IUPAC Name2-(2-methylphenoxy)pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1cccnc1Oc1ccccc1C
InChIInChI=1S/C13H13N3O/c1-9-5-2-3-7-11(9)17-13-10(12(14)15)6-4-8-16-13/h2-8H,1H3,(H3,14,15)
InChIKeyFHYQPFPHQIVOBL-UHFFFAOYSA-N
XLogP2.47
TPSA71.99 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.27
LogP ≤ 52.47
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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Related Compounds

2-(2-phenylphenoxy)pyridine-3-carboximidamide
CID 24699943
2-(2-nitrophenoxy)pyridine-3-carboximidamide
CID 54915747
2-(2-nitrophenoxy)pyridine-3-carboximidamide;hydrochloride
CID 82240737
2-(2-methylphenoxy)-6-(trifluoromethyl)pyridine-3-carboximidamide
CID 79875024
2-(1-bromonaphthalen-2-yl)oxypyridine-3-carboximidamide
CID 61028499
2-(4-tert-butylphenoxy)pyridine-3-carboximidamide;hydrochloride
CID 82253632
2-[3-(dimethylamino)propoxy]pyridine-3-carboximidamide;hydrochloride
CID 82253262
2-hexoxypyridine-3-carboximidamide
CID 29002899
2-(pyridin-2-ylmethoxy)pyridine-3-carboximidamide
CID 82240665
N-[4-[(3-carbamimidoyl-2-pyridinyl)oxy]phenyl]acetamide
CID 82253649
2-(2,5-difluoro-4-nitrophenoxy)pyridine-3-carboximidamide
CID 63599016
5-(2-methylphenoxy)pyridine-2-carboximidamide
CID 113321278

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylphenoxy)pyridine-3-carboximidamide?
The IUPAC name of 2-(2-methylphenoxy)pyridine-3-carboximidamide (CID 24707903) is 2-(2-methylphenoxy)pyridine-3-carboximidamide.
What is the SMILES notation for 2-(2-methylphenoxy)pyridine-3-carboximidamide?
The canonical SMILES for 2-(2-methylphenoxy)pyridine-3-carboximidamide is [H]/N=C(\N)c1cccnc1Oc1ccccc1C.
What is the InChIKey of 2-(2-methylphenoxy)pyridine-3-carboximidamide?
The InChIKey is FHYQPFPHQIVOBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O/c1-9-5-2-3-7-11(9)17-13-10(12(14)15)6-4-8-16-13/h2-8H,1H3,(H3,14,15).
What are the key properties of 2-(2-methylphenoxy)pyridine-3-carboximidamide?
2-(2-methylphenoxy)pyridine-3-carboximidamide has a molecular weight of 227.27 g/mol, XLogP of 2.47, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylphenoxy)pyridine-3-carboximidamide is sourced from PubChem (CID 24707903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).