3-amino-4-hydrazinylphenol

C6H9N3O — CID 119000444

IUPAC3-amino-4-hydrazinylphenol
SMILESNNc1ccc(O)cc1N
InChIInChI=1S/C6H9N3O/c7-5-3-4(10)1-2-6(5)9-8/h1-3,9-10H,7-8H2
InChIKeyMCSCPDZBKRQDBO-UHFFFAOYSA-N
MW139.16 g/mol
LogP0.26
Rot. Bonds1

About 3-amino-4-hydrazinylphenol

3-amino-4-hydrazinylphenol (PubChem CID 119000444) has the molecular formula C6H9N3O and a molecular weight of 139.16 g/mol. Its IUPAC name is 3-amino-4-hydrazinylphenol.

Molecular Properties

Compound Name3-amino-4-hydrazinylphenol
PubChem CID119000444
Molecular FormulaC6H9N3O
Molecular Weight139.16 g/mol
Exact Mass139.07
IUPAC Name3-amino-4-hydrazinylphenol
SMILESNNc1ccc(O)cc1N
InChIInChI=1S/C6H9N3O/c7-5-3-4(10)1-2-6(5)9-8/h1-3,9-10H,7-8H2
InChIKeyMCSCPDZBKRQDBO-UHFFFAOYSA-N
XLogP0.26
TPSA84.30 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.16
LogP ≤ 50.26
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-hydrazinyl-5-methylaniline
CID 89276855
3-amino-4-(propylamino)phenol
CID 166450854
3-(bromomethyl)-4-hydrazinylphenol
CID 130779190
3-amino-4-(4-methylanilino)phenol
CID 91593642
3-hydrazinyl-4-methylphenol
CID 130980882
N-(2-amino-4-hydroxyphenyl)-2-methylpropanamide
CID 107697096
2-hydrazinyl-5-methoxyaniline
CID 119013430
3-amino-4-[(4-bromophenyl)methylamino]phenol
CID 90415269
methyl 3-amino-4-hydrazinylbenzoate
CID 22411187
3-(2-amino-4-hydroxyphenyl)-1,1-diethylurea
CID 107698052
2-hydrazinyl-5-nitroaniline
CID 130769325
3-amino-4-(2-methylpropylsulfamoylamino)phenol
CID 107697833

Frequently Asked Questions

What is the IUPAC name of 3-amino-4-hydrazinylphenol?
The IUPAC name of 3-amino-4-hydrazinylphenol (CID 119000444) is 3-amino-4-hydrazinylphenol.
What is the SMILES notation for 3-amino-4-hydrazinylphenol?
The canonical SMILES for 3-amino-4-hydrazinylphenol is NNc1ccc(O)cc1N.
What is the InChIKey of 3-amino-4-hydrazinylphenol?
The InChIKey is MCSCPDZBKRQDBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O/c7-5-3-4(10)1-2-6(5)9-8/h1-3,9-10H,7-8H2.
What are the key properties of 3-amino-4-hydrazinylphenol?
3-amino-4-hydrazinylphenol has a molecular weight of 139.16 g/mol, XLogP of 0.26, 1 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4-hydrazinylphenol is sourced from PubChem (CID 119000444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).