2-hydrazinyl-3-(4-hydroxyphenyl)propanamide

C9H13N3O2 — CID 144742434

IUPAC2-hydrazinyl-3-(4-hydroxyphenyl)propanamide
SMILESNNC(Cc1ccc(O)cc1)C(N)=O
InChIInChI=1S/C9H13N3O2/c10-9(14)8(12-11)5-6-1-3-7(13)4-2-6/h1-4,8,12-13H,5,11H2,(H2,10,14)
InChIKeyIYLWQKBZFRREAK-UHFFFAOYSA-N
MW195.22 g/mol
LogP-0.75
Rot. Bonds4

About 2-hydrazinyl-3-(4-hydroxyphenyl)propanamide

2-hydrazinyl-3-(4-hydroxyphenyl)propanamide (PubChem CID 144742434) has the molecular formula C9H13N3O2 and a molecular weight of 195.22 g/mol. Its IUPAC name is 2-hydrazinyl-3-(4-hydroxyphenyl)propanamide.

Molecular Properties

Compound Name2-hydrazinyl-3-(4-hydroxyphenyl)propanamide
PubChem CID144742434
Molecular FormulaC9H13N3O2
Molecular Weight195.22 g/mol
Exact Mass195.10
IUPAC Name2-hydrazinyl-3-(4-hydroxyphenyl)propanamide
SMILESNNC(Cc1ccc(O)cc1)C(N)=O
InChIInChI=1S/C9H13N3O2/c10-9(14)8(12-11)5-6-1-3-7(13)4-2-6/h1-4,8,12-13H,5,11H2,(H2,10,14)
InChIKeyIYLWQKBZFRREAK-UHFFFAOYSA-N
XLogP-0.75
TPSA101.37 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 5-0.75
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2S)-2-hydrazinyl-3-(4-hydroxyphenyl)propanoyl iodide
CID 89094308
(2S)-2-[2-[1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]hydrazinyl]-3-hydroxypropanoic acid
CID 91120365
3-(4-hydroxyphenyl)-2-[3-(4-hydroxyphenyl)propanoylamino]propanamide
CID 71080092
azane;3-(4-hydroxyphenyl)-2-(methylamino)propanamide;3-(4-hydroxyphenyl)-2-(methylamino)propanoic acid
CID 158661642
[[(2S)-1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino] prop-2-enoate
CID 151559581
ethane;2-[2-(hydroxyamino)ethylamino]-3-(4-hydroxyphenyl)propanamide
CID 142338816
N-[1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-2-methylprop-2-enamide
CID 19980707
[(2S)-1-[[(2S)-1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]carbamic acid
CID 155091237
(2S)-2-[(2-acetamidoacetyl)amino]-3-(4-hydroxyphenyl)propanamide
CID 172868534
2-[[2-[(2-aminoacetyl)amino]acetyl]amino]-3-(4-hydroxyphenyl)propanamide
CID 4667426
(2R)-2-amino-3-(4-hydroxyphenyl)propanamide
CID 10511575
[1-[[1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]carbamic acid
CID 155091225

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-3-(4-hydroxyphenyl)propanamide?
The IUPAC name of 2-hydrazinyl-3-(4-hydroxyphenyl)propanamide (CID 144742434) is 2-hydrazinyl-3-(4-hydroxyphenyl)propanamide.
What is the SMILES notation for 2-hydrazinyl-3-(4-hydroxyphenyl)propanamide?
The canonical SMILES for 2-hydrazinyl-3-(4-hydroxyphenyl)propanamide is NNC(Cc1ccc(O)cc1)C(N)=O.
What is the InChIKey of 2-hydrazinyl-3-(4-hydroxyphenyl)propanamide?
The InChIKey is IYLWQKBZFRREAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2/c10-9(14)8(12-11)5-6-1-3-7(13)4-2-6/h1-4,8,12-13H,5,11H2,(H2,10,14).
What are the key properties of 2-hydrazinyl-3-(4-hydroxyphenyl)propanamide?
2-hydrazinyl-3-(4-hydroxyphenyl)propanamide has a molecular weight of 195.22 g/mol, XLogP of -0.75, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-3-(4-hydroxyphenyl)propanamide is sourced from PubChem (CID 144742434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).