2-(2-fluoro-6-methylphenyl)-2-hydroxyacetohydrazide

C9H11FN2O2 — CID 163953467

IUPAC2-(2-fluoro-6-methylphenyl)-2-hydroxyacetohydrazide
SMILESCc1cccc(F)c1C(O)C(=O)NN
InChIInChI=1S/C9H11FN2O2/c1-5-3-2-4-6(10)7(5)8(13)9(14)12-11/h2-4,8,13H,11H2,1H3,(H,12,14)
InChIKeySBITXVCPGRIHOI-UHFFFAOYSA-N
MW198.20 g/mol
LogP0.16
Rot. Bonds2

About 2-(2-fluoro-6-methylphenyl)-2-hydroxyacetohydrazide

2-(2-fluoro-6-methylphenyl)-2-hydroxyacetohydrazide (PubChem CID 163953467) has the molecular formula C9H11FN2O2 and a molecular weight of 198.20 g/mol. Its IUPAC name is 2-(2-fluoro-6-methylphenyl)-2-hydroxyacetohydrazide.

Molecular Properties

Compound Name2-(2-fluoro-6-methylphenyl)-2-hydroxyacetohydrazide
PubChem CID163953467
Molecular FormulaC9H11FN2O2
Molecular Weight198.20 g/mol
Exact Mass198.08
IUPAC Name2-(2-fluoro-6-methylphenyl)-2-hydroxyacetohydrazide
SMILESCc1cccc(F)c1C(O)C(=O)NN
InChIInChI=1S/C9H11FN2O2/c1-5-3-2-4-6(10)7(5)8(13)9(14)12-11/h2-4,8,13H,11H2,1H3,(H,12,14)
InChIKeySBITXVCPGRIHOI-UHFFFAOYSA-N
XLogP0.16
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.20
LogP ≤ 50.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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

(2R)-2-amino-2-(2-fluoro-6-methylphenyl)acetic acid
CID 130997783
methyl 2-(2-fluoro-6-methoxyphenyl)-2-hydroxyacetate
CID 117305035
3-(2-fluorophenyl)sulfanyl-2-methylbutanehydrazide
CID 79405140
methyl 2-[2-(dimethylamino)-6-methylphenyl]-2-hydroxyacetate
CID 117108701
2-(2-fluoro-6-methylphenyl)propan-1-amine
CID 84765270
2-[2-(3-ethoxy-3-oxopropyl)-6-fluorophenyl]-2-hydroxyacetic acid
CID 118847911
(2R)-2-amino-N-[1-(2,6-difluorophenyl)ethyl]propanamide;hydrochloride
CID 119285523
1-(2,6-difluorophenyl)ethanol
CID 5012075
(2,6-difluoro-3-methylphenyl)-(2,6-difluorophenyl)methanol
CID 82820156
ethyl 2-[3-fluoro-2-(1-fluoroethyl)phenyl]-2-hydroxyacetate
CID 117362052
(2S)-2-hydroxy-2-(3-methoxyphenyl)acetohydrazide
CID 124673307
3-[(2-amino-3-methylphenyl)sulfanylmethyl]-4-fluorobenzohydrazide
CID 107459216

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-6-methylphenyl)-2-hydroxyacetohydrazide?
The IUPAC name of 2-(2-fluoro-6-methylphenyl)-2-hydroxyacetohydrazide (CID 163953467) is 2-(2-fluoro-6-methylphenyl)-2-hydroxyacetohydrazide.
What is the SMILES notation for 2-(2-fluoro-6-methylphenyl)-2-hydroxyacetohydrazide?
The canonical SMILES for 2-(2-fluoro-6-methylphenyl)-2-hydroxyacetohydrazide is Cc1cccc(F)c1C(O)C(=O)NN.
What is the InChIKey of 2-(2-fluoro-6-methylphenyl)-2-hydroxyacetohydrazide?
The InChIKey is SBITXVCPGRIHOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FN2O2/c1-5-3-2-4-6(10)7(5)8(13)9(14)12-11/h2-4,8,13H,11H2,1H3,(H,12,14).
What are the key properties of 2-(2-fluoro-6-methylphenyl)-2-hydroxyacetohydrazide?
2-(2-fluoro-6-methylphenyl)-2-hydroxyacetohydrazide has a molecular weight of 198.20 g/mol, XLogP of 0.16, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-6-methylphenyl)-2-hydroxyacetohydrazide is sourced from PubChem (CID 163953467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).