6-(2,6-dimethoxyphenoxy)pyridine-2-carboximidamide

C14H15N3O3 — CID 64596167

IUPAC6-(2,6-dimethoxyphenoxy)pyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1cccc(Oc2c(OC)cccc2OC)n1
InChIInChI=1S/C14H15N3O3/c1-18-10-6-4-7-11(19-2)13(10)20-12-8-3-5-9(17-12)14(15)16/h3-8H,1-2H3,(H3,15,16)
InChIKeyMDOQRYDOOSPCMC-UHFFFAOYSA-N
MW273.29 g/mol
LogP2.18
Rot. Bonds5

About 6-(2,6-dimethoxyphenoxy)pyridine-2-carboximidamide

6-(2,6-dimethoxyphenoxy)pyridine-2-carboximidamide (PubChem CID 64596167) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is 6-(2,6-dimethoxyphenoxy)pyridine-2-carboximidamide.

Molecular Properties

Compound Name6-(2,6-dimethoxyphenoxy)pyridine-2-carboximidamide
PubChem CID64596167
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC Name6-(2,6-dimethoxyphenoxy)pyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1cccc(Oc2c(OC)cccc2OC)n1
InChIInChI=1S/C14H15N3O3/c1-18-10-6-4-7-11(19-2)13(10)20-12-8-3-5-9(17-12)14(15)16/h3-8H,1-2H3,(H3,15,16)
InChIKeyMDOQRYDOOSPCMC-UHFFFAOYSA-N
XLogP2.18
TPSA90.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

6-(3,5-dimethoxyphenoxy)pyridine-2-carboximidamide
CID 64594798
6-(2,3,6-trimethylphenoxy)pyridine-2-carboximidamide
CID 64596172
6-(2-propan-2-ylphenoxy)pyridine-2-carboximidamide
CID 64595176
6-(2,6-dimethoxyphenoxy)pyridine-2-carboxylic acid
CID 62255155
6-(2-methoxyphenyl)pyridine-2-carboximidamide
CID 14281216
pyridine-2,6-dicarboximidamide
CID 23373306
2-chloro-6-(2,6-dimethoxyphenoxy)benzenecarboximidamide
CID 62496011
6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-2-carboximidamide
CID 104562293
6-(5-fluoro-2-nitrophenoxy)pyridine-2-carboximidamide
CID 64593831
6-heptoxypyridine-2-carboximidamide
CID 64594210
6-(3,3-dimethylbutoxy)pyridine-2-carboximidamide
CID 66232264
5-methoxyisoquinoline-1-carboximidamide
CID 82573377

Frequently Asked Questions

What is the IUPAC name of 6-(2,6-dimethoxyphenoxy)pyridine-2-carboximidamide?
The IUPAC name of 6-(2,6-dimethoxyphenoxy)pyridine-2-carboximidamide (CID 64596167) is 6-(2,6-dimethoxyphenoxy)pyridine-2-carboximidamide.
What is the SMILES notation for 6-(2,6-dimethoxyphenoxy)pyridine-2-carboximidamide?
The canonical SMILES for 6-(2,6-dimethoxyphenoxy)pyridine-2-carboximidamide is [H]/N=C(\N)c1cccc(Oc2c(OC)cccc2OC)n1.
What is the InChIKey of 6-(2,6-dimethoxyphenoxy)pyridine-2-carboximidamide?
The InChIKey is MDOQRYDOOSPCMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3/c1-18-10-6-4-7-11(19-2)13(10)20-12-8-3-5-9(17-12)14(15)16/h3-8H,1-2H3,(H3,15,16).
What are the key properties of 6-(2,6-dimethoxyphenoxy)pyridine-2-carboximidamide?
6-(2,6-dimethoxyphenoxy)pyridine-2-carboximidamide has a molecular weight of 273.29 g/mol, XLogP of 2.18, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,6-dimethoxyphenoxy)pyridine-2-carboximidamide is sourced from PubChem (CID 64596167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).