1-hydroxy-2-[(E)-2-(4-methoxyphenoxy)ethylideneamino]guanidine

C10H14N4O3 — CID 11838398

IUPAC1-hydroxy-2-[(E)-2-(4-methoxyphenoxy)ethylideneamino]guanidine
SMILESCOc1ccc(OC/C=N/N=C(\N)NO)cc1
InChIInChI=1S/C10H14N4O3/c1-16-8-2-4-9(5-3-8)17-7-6-12-13-10(11)14-15/h2-6,15H,7H2,1H3,(H3,11,13,14)/b12-6+
InChIKeyMUGKFNMEUSQIGS-WUXMJOGZSA-N
MW238.25 g/mol
LogP0.35
Rot. Bonds5

About 1-hydroxy-2-[(E)-2-(4-methoxyphenoxy)ethylideneamino]guanidine

1-hydroxy-2-[(E)-2-(4-methoxyphenoxy)ethylideneamino]guanidine (PubChem CID 11838398) has the molecular formula C10H14N4O3 and a molecular weight of 238.25 g/mol. Its IUPAC name is 1-hydroxy-2-[(E)-2-(4-methoxyphenoxy)ethylideneamino]guanidine.

Molecular Properties

Compound Name1-hydroxy-2-[(E)-2-(4-methoxyphenoxy)ethylideneamino]guanidine
PubChem CID11838398
Molecular FormulaC10H14N4O3
Molecular Weight238.25 g/mol
Exact Mass238.11
IUPAC Name1-hydroxy-2-[(E)-2-(4-methoxyphenoxy)ethylideneamino]guanidine
SMILESCOc1ccc(OC/C=N/N=C(\N)NO)cc1
InChIInChI=1S/C10H14N4O3/c1-16-8-2-4-9(5-3-8)17-7-6-12-13-10(11)14-15/h2-6,15H,7H2,1H3,(H3,11,13,14)/b12-6+
InChIKeyMUGKFNMEUSQIGS-WUXMJOGZSA-N
XLogP0.35
TPSA101.46 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 50.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[(E)-2-(2,4-dimethylphenoxy)ethylideneamino]-1-hydroxyguanidine
CID 14816037
2-[(E)-(2,5-dimethoxyphenyl)methylideneamino]-1-hydroxyguanidine
CID 173058134
bis(2-[(E)-2-(2,4-dimethylphenoxy)ethylideneamino]-1-hydroxyguanidine);sulfuric acid
CID 172886870
1-hydroxy-2-[(E)-3-methylbutylideneamino]guanidine
CID 172939717
[[amino-(hydroxyamino)methylidene]amino]-[(4-methoxyphenyl)methylidene]azanium
CID 4227157
1,2-bis[(E)-(4-methoxyphenyl)methylideneamino]guanidine
CID 54753081
1-[(E)-(4-methoxyphenyl)methylideneamino]-2-[(Z)-(4-methoxyphenyl)methylideneamino]guanidine
CID 119080623
1-(dihydroxyamino)-2-[(4-methoxyphenyl)methylideneamino]guanidine
CID 3802912
1-hydroxy-2-[(2,4,5-trimethoxyphenyl)methylideneamino]guanidine
CID 5494118
1-methoxy-4-[(E)-pent-2-enoxy]benzene
CID 176585225
(4-methoxyphenoxy)methanol
CID 20580272
2-[(E)-(5-bromo-2,3,4-trimethoxyphenyl)methylideneamino]-1-hydroxyguanidine
CID 173023877

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-2-[(E)-2-(4-methoxyphenoxy)ethylideneamino]guanidine?
The IUPAC name of 1-hydroxy-2-[(E)-2-(4-methoxyphenoxy)ethylideneamino]guanidine (CID 11838398) is 1-hydroxy-2-[(E)-2-(4-methoxyphenoxy)ethylideneamino]guanidine.
What is the SMILES notation for 1-hydroxy-2-[(E)-2-(4-methoxyphenoxy)ethylideneamino]guanidine?
The canonical SMILES for 1-hydroxy-2-[(E)-2-(4-methoxyphenoxy)ethylideneamino]guanidine is COc1ccc(OC/C=N/N=C(\N)NO)cc1.
What is the InChIKey of 1-hydroxy-2-[(E)-2-(4-methoxyphenoxy)ethylideneamino]guanidine?
The InChIKey is MUGKFNMEUSQIGS-WUXMJOGZSA-N. The full InChI is InChI=1S/C10H14N4O3/c1-16-8-2-4-9(5-3-8)17-7-6-12-13-10(11)14-15/h2-6,15H,7H2,1H3,(H3,11,13,14)/b12-6+.
What are the key properties of 1-hydroxy-2-[(E)-2-(4-methoxyphenoxy)ethylideneamino]guanidine?
1-hydroxy-2-[(E)-2-(4-methoxyphenoxy)ethylideneamino]guanidine has a molecular weight of 238.25 g/mol, XLogP of 0.35, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-2-[(E)-2-(4-methoxyphenoxy)ethylideneamino]guanidine is sourced from PubChem (CID 11838398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).