2-(2-methoxyanilino)pyridine-3-carboximidamide

C13H14N4O — CID 82253401

IUPAC2-(2-methoxyanilino)pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1cccnc1Nc1ccccc1OC
InChIInChI=1S/C13H14N4O/c1-18-11-7-3-2-6-10(11)17-13-9(12(14)15)5-4-8-16-13/h2-8H,1H3,(H3,14,15)(H,16,17)
InChIKeyBGIIDMNXPLXAPO-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.12
Rot. Bonds4

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

2-(2-methoxyanilino)pyridine-3-carboximidamide (PubChem CID 82253401) has the molecular formula C13H14N4O and a molecular weight of 242.28 g/mol. Its IUPAC name is 2-(2-methoxyanilino)pyridine-3-carboximidamide.

Molecular Properties

Compound Name2-(2-methoxyanilino)pyridine-3-carboximidamide
PubChem CID82253401
Molecular FormulaC13H14N4O
Molecular Weight242.28 g/mol
Exact Mass242.12
IUPAC Name2-(2-methoxyanilino)pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1cccnc1Nc1ccccc1OC
InChIInChI=1S/C13H14N4O/c1-18-11-7-3-2-6-10(11)17-13-9(12(14)15)5-4-8-16-13/h2-8H,1H3,(H3,14,15)(H,16,17)
InChIKeyBGIIDMNXPLXAPO-UHFFFAOYSA-N
XLogP2.12
TPSA84.02 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.12
H-Bond Donors ≤ 53
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

2-(2-methoxyanilino)-N-propylpyridine-3-carboxamide
CID 32736796
N-[(3,4-dimethoxyphenyl)methyl]-2-(2-methoxyanilino)pyridine-3-carboxamide
CID 55394070
N-(4-chlorophenyl)-2-(2-methoxyanilino)pyridine-3-carboxamide
CID 23632593
2-(2-methoxyphenoxy)benzenecarboximidamide
CID 28601438
N-(3,4-dichlorophenyl)-2-(2-methoxyanilino)pyridine-3-carboxamide
CID 23632728
[2-(4-hydroxyanilino)-2-oxoethyl] 2-(2-methoxyanilino)pyridine-3-carboxylate
CID 27908502
2-(2-methylphenoxy)pyridine-3-carboximidamide
CID 24707903
(1-propyltetrazol-5-yl)methyl 2-(2-methoxyanilino)pyridine-3-carboxylate
CID 27027534
(5-methyl-1,2-oxazol-3-yl)methyl 2-(2-methoxyanilino)pyridine-3-carboxylate
CID 27027662
[2-oxo-2-(4-propylphenyl)ethyl] 2-(2-methoxyanilino)pyridine-3-carboxylate
CID 4844062
2-(2,6-dimethylanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 23632545
2-(5-fluoro-2-methoxyanilino)pyridine-3-carboxylic acid
CID 178064933

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyanilino)pyridine-3-carboximidamide?
The IUPAC name of 2-(2-methoxyanilino)pyridine-3-carboximidamide (CID 82253401) is 2-(2-methoxyanilino)pyridine-3-carboximidamide.
What is the SMILES notation for 2-(2-methoxyanilino)pyridine-3-carboximidamide?
The canonical SMILES for 2-(2-methoxyanilino)pyridine-3-carboximidamide is [H]/N=C(\N)c1cccnc1Nc1ccccc1OC.
What is the InChIKey of 2-(2-methoxyanilino)pyridine-3-carboximidamide?
The InChIKey is BGIIDMNXPLXAPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O/c1-18-11-7-3-2-6-10(11)17-13-9(12(14)15)5-4-8-16-13/h2-8H,1H3,(H3,14,15)(H,16,17).
What are the key properties of 2-(2-methoxyanilino)pyridine-3-carboximidamide?
2-(2-methoxyanilino)pyridine-3-carboximidamide has a molecular weight of 242.28 g/mol, XLogP of 2.12, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyanilino)pyridine-3-carboximidamide is sourced from PubChem (CID 82253401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).