N'-hydroxy-4-methoxy-6-(4-methoxy-2-pyridinyl)pyridine-2-carboximidamide

C13H14N4O3 — CID 135455563

IUPACN'-hydroxy-4-methoxy-6-(4-methoxy-2-pyridinyl)pyridine-2-carboximidamide
SMILESCOc1ccnc(-c2cc(OC)cc(/C(N)=N/O)n2)c1
InChIInChI=1S/C13H14N4O3/c1-19-8-3-4-15-10(5-8)11-6-9(20-2)7-12(16-11)13(14)17-18/h3-7,18H,1-2H3,(H2,14,17)
InChIKeyDPYZNIUKECRBRR-UHFFFAOYSA-N
MW274.28 g/mol
LogP1.26
Rot. Bonds4

About N'-hydroxy-4-methoxy-6-(4-methoxy-2-pyridinyl)pyridine-2-carboximidamide

N'-hydroxy-4-methoxy-6-(4-methoxy-2-pyridinyl)pyridine-2-carboximidamide (PubChem CID 135455563) has the molecular formula C13H14N4O3 and a molecular weight of 274.28 g/mol. Its IUPAC name is N'-hydroxy-4-methoxy-6-(4-methoxy-2-pyridinyl)pyridine-2-carboximidamide.

Molecular Properties

Compound NameN'-hydroxy-4-methoxy-6-(4-methoxy-2-pyridinyl)pyridine-2-carboximidamide
PubChem CID135455563
Molecular FormulaC13H14N4O3
Molecular Weight274.28 g/mol
Exact Mass274.11
IUPAC NameN'-hydroxy-4-methoxy-6-(4-methoxy-2-pyridinyl)pyridine-2-carboximidamide
SMILESCOc1ccnc(-c2cc(OC)cc(/C(N)=N/O)n2)c1
InChIInChI=1S/C13H14N4O3/c1-19-8-3-4-15-10(5-8)11-6-9(20-2)7-12(16-11)13(14)17-18/h3-7,18H,1-2H3,(H2,14,17)
InChIKeyDPYZNIUKECRBRR-UHFFFAOYSA-N
XLogP1.26
TPSA102.85 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.28
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

bis(4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine);decakis(oxygen(2-));tungsten;bis(vanadium)
CID 53380093
4-methoxypyridine-2-carbothioamide
CID 62926631
N'-hydroxy-2-(4-methoxyphenyl)sulfanylpyrimidine-4-carboximidamide
CID 136678350
N'-hydroxy-5-methoxypyridine-2-carboximidamide
CID 135743705
N'-hydroxy-4-methoxybenzenecarboximidamide
CID 5374066
N'-hydroxy-4-[5-[[2-[(Z)-N'-hydroxycarbamimidoyl]-4-pyridinyl]oxy]pentoxy]pyridine-2-carboximidamide
CID 135878418
5-(3,5-dimethoxyphenoxy)-N'-hydroxypyridine-2-carboximidamide
CID 136990840
N'-hydroxy-2-(4-methoxy-2-pyridinyl)ethanimidamide
CID 83875685
2-[[2,6-bis(4-methoxy-2-pyridinyl)-4-pyridinyl]sulfanyl]ethanamine
CID 122205488
4-[(2-bromo-4-methoxyphenoxy)methyl]-N'-hydroxypyridine-2-carboximidamide
CID 136869301
4-methoxy-2-(4-methoxy-2-pyridinyl)pyridine;bis(1-methyl-2-(1-methylimidazol-2-yl)imidazole);osmium;trichloride
CID 158814278
4-[2-(diethylamino)ethoxy]-N'-hydroxypyridine-2-carboximidamide
CID 135965118

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-4-methoxy-6-(4-methoxy-2-pyridinyl)pyridine-2-carboximidamide?
The IUPAC name of N'-hydroxy-4-methoxy-6-(4-methoxy-2-pyridinyl)pyridine-2-carboximidamide (CID 135455563) is N'-hydroxy-4-methoxy-6-(4-methoxy-2-pyridinyl)pyridine-2-carboximidamide.
What is the SMILES notation for N'-hydroxy-4-methoxy-6-(4-methoxy-2-pyridinyl)pyridine-2-carboximidamide?
The canonical SMILES for N'-hydroxy-4-methoxy-6-(4-methoxy-2-pyridinyl)pyridine-2-carboximidamide is COc1ccnc(-c2cc(OC)cc(/C(N)=N/O)n2)c1.
What is the InChIKey of N'-hydroxy-4-methoxy-6-(4-methoxy-2-pyridinyl)pyridine-2-carboximidamide?
The InChIKey is DPYZNIUKECRBRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O3/c1-19-8-3-4-15-10(5-8)11-6-9(20-2)7-12(16-11)13(14)17-18/h3-7,18H,1-2H3,(H2,14,17).
What are the key properties of N'-hydroxy-4-methoxy-6-(4-methoxy-2-pyridinyl)pyridine-2-carboximidamide?
N'-hydroxy-4-methoxy-6-(4-methoxy-2-pyridinyl)pyridine-2-carboximidamide has a molecular weight of 274.28 g/mol, XLogP of 1.26, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-4-methoxy-6-(4-methoxy-2-pyridinyl)pyridine-2-carboximidamide is sourced from PubChem (CID 135455563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).