(2S)-2-hydroxy-2-(3-methoxyphenyl)acetohydrazide

C9H12N2O3 — CID 124673307

IUPAC(2S)-2-hydroxy-2-(3-methoxyphenyl)acetohydrazide
SMILESCOc1cccc([C@H](O)C(=O)NN)c1
InChIInChI=1S/C9H12N2O3/c1-14-7-4-2-3-6(5-7)8(12)9(13)11-10/h2-5,8,12H,10H2,1H3,(H,11,13)/t8-/m0/s1
InChIKeyPDRKKTSVMKHHGO-QMMMGPOBSA-N
MW196.21 g/mol
LogP-0.28
Rot. Bonds3

About (2S)-2-hydroxy-2-(3-methoxyphenyl)acetohydrazide

(2S)-2-hydroxy-2-(3-methoxyphenyl)acetohydrazide (PubChem CID 124673307) has the molecular formula C9H12N2O3 and a molecular weight of 196.21 g/mol. Its IUPAC name is (2S)-2-hydroxy-2-(3-methoxyphenyl)acetohydrazide.

Molecular Properties

Compound Name(2S)-2-hydroxy-2-(3-methoxyphenyl)acetohydrazide
PubChem CID124673307
Molecular FormulaC9H12N2O3
Molecular Weight196.21 g/mol
Exact Mass196.08
IUPAC Name(2S)-2-hydroxy-2-(3-methoxyphenyl)acetohydrazide
SMILESCOc1cccc([C@H](O)C(=O)NN)c1
InChIInChI=1S/C9H12N2O3/c1-14-7-4-2-3-6(5-7)8(12)9(13)11-10/h2-5,8,12H,10H2,1H3,(H,11,13)/t8-/m0/s1
InChIKeyPDRKKTSVMKHHGO-QMMMGPOBSA-N
XLogP-0.28
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 5-0.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-hydroxy-N-(3-methoxyphenyl)-2-phenylacetamide
CID 82132314
methyl (2R)-2-amino-2-(3-methoxyphenyl)acetate;hydrochloride
CID 171219744
methyl 2-[hydroxy-(3-methoxyphenyl)methyl]-3-methylbutanoate
CID 62394027
1-(3-methoxyphenyl)-2-methylprop-2-en-1-ol
CID 79189676
2-(3-methoxyphenyl)-2-(methylamino)acetamide
CID 60797274
2-amino-N-[(1R)-1-(3-methoxyphenyl)ethyl]propanamide
CID 81372926
(2R)-2-(3-methoxyphenyl)propanamide
CID 130713337
(1R)-1-(3-methoxyphenyl)ethanol
CID 10219539
3-amino-2-hydroxy-3-(3-methoxyphenyl)propanoic acid
CID 53398455
2-chloro-2-(3-methoxyphenyl)-N-methylacetamide
CID 10036152
2-amino-2-(3-methoxyphenyl)-N',N'-dimethylacetohydrazide
CID 116849865
N-(2-hydroxypropoxy)-2-(3-methoxyphenyl)propanamide
CID 138015024

Frequently Asked Questions

What is the IUPAC name of (2S)-2-hydroxy-2-(3-methoxyphenyl)acetohydrazide?
The IUPAC name of (2S)-2-hydroxy-2-(3-methoxyphenyl)acetohydrazide (CID 124673307) is (2S)-2-hydroxy-2-(3-methoxyphenyl)acetohydrazide.
What is the SMILES notation for (2S)-2-hydroxy-2-(3-methoxyphenyl)acetohydrazide?
The canonical SMILES for (2S)-2-hydroxy-2-(3-methoxyphenyl)acetohydrazide is COc1cccc([C@H](O)C(=O)NN)c1.
What is the InChIKey of (2S)-2-hydroxy-2-(3-methoxyphenyl)acetohydrazide?
The InChIKey is PDRKKTSVMKHHGO-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H12N2O3/c1-14-7-4-2-3-6(5-7)8(12)9(13)11-10/h2-5,8,12H,10H2,1H3,(H,11,13)/t8-/m0/s1.
What are the key properties of (2S)-2-hydroxy-2-(3-methoxyphenyl)acetohydrazide?
(2S)-2-hydroxy-2-(3-methoxyphenyl)acetohydrazide has a molecular weight of 196.21 g/mol, XLogP of -0.28, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-hydroxy-2-(3-methoxyphenyl)acetohydrazide is sourced from PubChem (CID 124673307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).