1-hydroxy-2-[(E)-(4-hydroxyphenyl)methylideneamino]guanidine

C8H10N4O2 — CID 135430293

IUPAC1-hydroxy-2-[(E)-(4-hydroxyphenyl)methylideneamino]guanidine
SMILESN/C(=N\N=C\c1ccc(O)cc1)NO
InChIInChI=1S/C8H10N4O2/c9-8(12-14)11-10-5-6-1-3-7(13)4-2-6/h1-5,13-14H,(H3,9,11,12)/b10-5+
InChIKeyQUBAJXFKYCMGJT-BJMVGYQFSA-N
MW194.19 g/mol
LogP0.02
Rot. Bonds2

About 1-hydroxy-2-[(E)-(4-hydroxyphenyl)methylideneamino]guanidine

1-hydroxy-2-[(E)-(4-hydroxyphenyl)methylideneamino]guanidine (PubChem CID 135430293) has the molecular formula C8H10N4O2 and a molecular weight of 194.19 g/mol. Its IUPAC name is 1-hydroxy-2-[(E)-(4-hydroxyphenyl)methylideneamino]guanidine.

Molecular Properties

Compound Name1-hydroxy-2-[(E)-(4-hydroxyphenyl)methylideneamino]guanidine
PubChem CID135430293
Molecular FormulaC8H10N4O2
Molecular Weight194.19 g/mol
Exact Mass194.08
IUPAC Name1-hydroxy-2-[(E)-(4-hydroxyphenyl)methylideneamino]guanidine
SMILESN/C(=N\N=C\c1ccc(O)cc1)NO
InChIInChI=1S/C8H10N4O2/c9-8(12-14)11-10-5-6-1-3-7(13)4-2-6/h1-5,13-14H,(H3,9,11,12)/b10-5+
InChIKeyQUBAJXFKYCMGJT-BJMVGYQFSA-N
XLogP0.02
TPSA103.23 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.19
LogP ≤ 50.02
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_B(215)', 'substructure': 'N/A'}, {'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

Salicylaldoxime
CID 135408751
4-Hydroxybenzaldehyde oxime
CID 135408704
Salicylaldazine
CID 135400567
4-Hydroxybenzaldehyde thiosemicarbazone
CID 135408731
4-hydroxybenzaldehyde [(1E)-(4-hydroxyphenyl)methylene]hydrazone
CID 135460511
4-Hydroxybenzaldehyde semicarbazone
CID 135400267
(Z)-(4-hydroxyphenyl)acetaldehyde oxime
CID 5459810
1,3-Bis[(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]urea
CID 135458727
Alpha-(2-hydroxyethylimino)-P-cresol
CID 121565
Benzaldehyde, 3,5-diiodo-4-hydroxy-, oxime
CID 135408525
3-Hydroxybenzaldehyde azine
CID 6895745
Salicylaldehyde hydrazone
CID 135484217

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-2-[(E)-(4-hydroxyphenyl)methylideneamino]guanidine?
The IUPAC name of 1-hydroxy-2-[(E)-(4-hydroxyphenyl)methylideneamino]guanidine (CID 135430293) is 1-hydroxy-2-[(E)-(4-hydroxyphenyl)methylideneamino]guanidine.
What is the SMILES notation for 1-hydroxy-2-[(E)-(4-hydroxyphenyl)methylideneamino]guanidine?
The canonical SMILES for 1-hydroxy-2-[(E)-(4-hydroxyphenyl)methylideneamino]guanidine is N/C(=N\N=C\c1ccc(O)cc1)NO.
What is the InChIKey of 1-hydroxy-2-[(E)-(4-hydroxyphenyl)methylideneamino]guanidine?
The InChIKey is QUBAJXFKYCMGJT-BJMVGYQFSA-N. The full InChI is InChI=1S/C8H10N4O2/c9-8(12-14)11-10-5-6-1-3-7(13)4-2-6/h1-5,13-14H,(H3,9,11,12)/b10-5+.
What are the key properties of 1-hydroxy-2-[(E)-(4-hydroxyphenyl)methylideneamino]guanidine?
1-hydroxy-2-[(E)-(4-hydroxyphenyl)methylideneamino]guanidine has a molecular weight of 194.19 g/mol, XLogP of 0.02, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-2-[(E)-(4-hydroxyphenyl)methylideneamino]guanidine is sourced from PubChem (CID 135430293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).