(2R)-N'-[2-(3-ethylphenoxy)acetyl]-2-(4-fluorophenoxy)propanehydrazide

C19H21FN2O4 — CID 9368194

IUPAC(2R)-N'-[2-(3-ethylphenoxy)acetyl]-2-(4-fluorophenoxy)propanehydrazide
SMILESCCc1cccc(OCC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1
InChIInChI=1S/C19H21FN2O4/c1-3-14-5-4-6-17(11-14)25-12-18(23)21-22-19(24)13(2)26-16-9-7-15(20)8-10-16/h4-11,13H,3,12H2,1-2H3,(H,21,23)(H,22,24)/t13-/m1/s1
InChIKeyLJHBTIDLZSWZAF-CYBMUJFWSA-N
MW360.39 g/mol
LogP2.38
Rot. Bonds7

About (2R)-N'-[2-(3-ethylphenoxy)acetyl]-2-(4-fluorophenoxy)propanehydrazide

(2R)-N'-[2-(3-ethylphenoxy)acetyl]-2-(4-fluorophenoxy)propanehydrazide (PubChem CID 9368194) has the molecular formula C19H21FN2O4 and a molecular weight of 360.39 g/mol. Its IUPAC name is (2R)-N'-[2-(3-ethylphenoxy)acetyl]-2-(4-fluorophenoxy)propanehydrazide.

Molecular Properties

Compound Name(2R)-N'-[2-(3-ethylphenoxy)acetyl]-2-(4-fluorophenoxy)propanehydrazide
PubChem CID9368194
Molecular FormulaC19H21FN2O4
Molecular Weight360.39 g/mol
Exact Mass360.15
IUPAC Name(2R)-N'-[2-(3-ethylphenoxy)acetyl]-2-(4-fluorophenoxy)propanehydrazide
SMILESCCc1cccc(OCC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1
InChIInChI=1S/C19H21FN2O4/c1-3-14-5-4-6-17(11-14)25-12-18(23)21-22-19(24)13(2)26-16-9-7-15(20)8-10-16/h4-11,13H,3,12H2,1-2H3,(H,21,23)(H,22,24)/t13-/m1/s1
InChIKeyLJHBTIDLZSWZAF-CYBMUJFWSA-N
XLogP2.38
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.39
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(4-fluorophenoxy)-N'-[2-(3-methylphenoxy)acetyl]propanehydrazide
CID 24638267
(2S)-2-(4-fluorophenoxy)-N'-(2-naphthalen-2-yloxyacetyl)propanehydrazide
CID 9368212
(2R)-2-(4-ethylphenoxy)-N'-[2-(4-ethylphenoxy)acetyl]propanehydrazide
CID 9238118
(2S)-N'-[2-(4-chlorophenoxy)acetyl]-2-(4-fluorophenoxy)propanehydrazide
CID 40611223
(2R)-N'-[2-(4-bromophenoxy)acetyl]-2-(4-fluorophenoxy)propanehydrazide
CID 7964947
N'-acetyl-2-(3-ethylphenoxy)acetohydrazide
CID 43011736
(2R)-2-(4-fluorophenoxy)-N'-[2-[3-(trifluoromethyl)phenyl]acetyl]propanehydrazide
CID 7965258
(2S)-N'-[2-(3-chlorophenoxy)acetyl]-2-(4-ethoxyphenoxy)propanehydrazide
CID 9343185
(2R)-N-[(3-ethoxyphenyl)methyl]-2-(4-fluorophenoxy)propanamide
CID 28567347
(2S)-2-(4-fluorophenoxy)-N'-[3-(3-methylphenoxy)propanoyl]propanehydrazide
CID 7964944
(2S)-N'-[3-(4-ethylphenyl)propanoyl]-2-(4-fluorophenoxy)propanehydrazide
CID 9429083
N'-[2-(4-ethylphenoxy)acetyl]-2-(2-fluorophenoxy)propanehydrazide
CID 78565397

Frequently Asked Questions

What is the IUPAC name of (2R)-N'-[2-(3-ethylphenoxy)acetyl]-2-(4-fluorophenoxy)propanehydrazide?
The IUPAC name of (2R)-N'-[2-(3-ethylphenoxy)acetyl]-2-(4-fluorophenoxy)propanehydrazide (CID 9368194) is (2R)-N'-[2-(3-ethylphenoxy)acetyl]-2-(4-fluorophenoxy)propanehydrazide.
What is the SMILES notation for (2R)-N'-[2-(3-ethylphenoxy)acetyl]-2-(4-fluorophenoxy)propanehydrazide?
The canonical SMILES for (2R)-N'-[2-(3-ethylphenoxy)acetyl]-2-(4-fluorophenoxy)propanehydrazide is CCc1cccc(OCC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1.
What is the InChIKey of (2R)-N'-[2-(3-ethylphenoxy)acetyl]-2-(4-fluorophenoxy)propanehydrazide?
The InChIKey is LJHBTIDLZSWZAF-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H21FN2O4/c1-3-14-5-4-6-17(11-14)25-12-18(23)21-22-19(24)13(2)26-16-9-7-15(20)8-10-16/h4-11,13H,3,12H2,1-2H3,(H,21,23)(H,22,24)/t13-/m1/s1.
What are the key properties of (2R)-N'-[2-(3-ethylphenoxy)acetyl]-2-(4-fluorophenoxy)propanehydrazide?
(2R)-N'-[2-(3-ethylphenoxy)acetyl]-2-(4-fluorophenoxy)propanehydrazide has a molecular weight of 360.39 g/mol, XLogP of 2.38, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N'-[2-(3-ethylphenoxy)acetyl]-2-(4-fluorophenoxy)propanehydrazide is sourced from PubChem (CID 9368194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).