N'-[2-(2,4-dimethoxyphenyl)acetyl]-2-(4-fluorophenoxy)propanehydrazide

C19H21FN2O5 — CID 46521372

IUPACN'-[2-(2,4-dimethoxyphenyl)acetyl]-2-(4-fluorophenoxy)propanehydrazide
SMILESCOc1ccc(CC(=O)NNC(=O)C(C)Oc2ccc(F)cc2)c(OC)c1
InChIInChI=1S/C19H21FN2O5/c1-12(27-15-8-5-14(20)6-9-15)19(24)22-21-18(23)10-13-4-7-16(25-2)11-17(13)26-3/h4-9,11-12H,10H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyAMJIXRFEICCUGI-UHFFFAOYSA-N
MW376.38 g/mol
LogP2.00
Rot. Bonds7

About N'-[2-(2,4-dimethoxyphenyl)acetyl]-2-(4-fluorophenoxy)propanehydrazide

N'-[2-(2,4-dimethoxyphenyl)acetyl]-2-(4-fluorophenoxy)propanehydrazide (PubChem CID 46521372) has the molecular formula C19H21FN2O5 and a molecular weight of 376.38 g/mol. Its IUPAC name is N'-[2-(2,4-dimethoxyphenyl)acetyl]-2-(4-fluorophenoxy)propanehydrazide.

Molecular Properties

Compound NameN'-[2-(2,4-dimethoxyphenyl)acetyl]-2-(4-fluorophenoxy)propanehydrazide
PubChem CID46521372
Molecular FormulaC19H21FN2O5
Molecular Weight376.38 g/mol
Exact Mass376.14
IUPAC NameN'-[2-(2,4-dimethoxyphenyl)acetyl]-2-(4-fluorophenoxy)propanehydrazide
SMILESCOc1ccc(CC(=O)NNC(=O)C(C)Oc2ccc(F)cc2)c(OC)c1
InChIInChI=1S/C19H21FN2O5/c1-12(27-15-8-5-14(20)6-9-15)19(24)22-21-18(23)10-13-4-7-16(25-2)11-17(13)26-3/h4-9,11-12H,10H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyAMJIXRFEICCUGI-UHFFFAOYSA-N
XLogP2.00
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.38
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

(2S)-N'-[(2R)-2-(4-fluorophenoxy)propanoyl]-2-(4-methoxyphenoxy)propanehydrazide
CID 42091432
N'-[2-(2,5-dimethoxyphenyl)acetyl]-2-(4-fluorophenyl)acetohydrazide
CID 78822007
N'-[2-(3-bromo-4-fluorophenyl)acetyl]-2-(4-fluorophenoxy)propanehydrazide
CID 55857189
(2S)-N'-[3-(3,5-dimethoxyphenyl)propanoyl]-2-(4-fluorophenoxy)propanehydrazide
CID 9091757
2-(4-fluorophenoxy)-N'-[3-(3,4,5-trimethoxyphenyl)propanoyl]propanehydrazide
CID 24638285
2-(2,4-dimethoxyphenyl)-N-(4-fluorophenyl)acetamide
CID 9400761
(2R)-N'-[2-(4-bromophenyl)acetyl]-2-(4-fluorophenoxy)propanehydrazide
CID 9368009
2-(2,4-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]acetamide
CID 27256771
N-[2-[2-[2-(4-fluorophenoxy)propanoyl]hydrazinyl]-2-oxoethyl]-4-methoxybenzenesulfonamide
CID 24638338
N-[2-[2-[2-(4-fluorophenoxy)propanoyl]hydrazinyl]-2-oxoethyl]-3,4,5-trimethoxybenzamide
CID 43004148
N'-[2-(4-fluorophenoxy)propanoyl]-3,3-dimethylbutanehydrazide
CID 46656768
2-(4-fluorophenoxy)-N'-[3-(4-fluorophenyl)propanoyl]propanehydrazide
CID 51195832

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2,4-dimethoxyphenyl)acetyl]-2-(4-fluorophenoxy)propanehydrazide?
The IUPAC name of N'-[2-(2,4-dimethoxyphenyl)acetyl]-2-(4-fluorophenoxy)propanehydrazide (CID 46521372) is N'-[2-(2,4-dimethoxyphenyl)acetyl]-2-(4-fluorophenoxy)propanehydrazide.
What is the SMILES notation for N'-[2-(2,4-dimethoxyphenyl)acetyl]-2-(4-fluorophenoxy)propanehydrazide?
The canonical SMILES for N'-[2-(2,4-dimethoxyphenyl)acetyl]-2-(4-fluorophenoxy)propanehydrazide is COc1ccc(CC(=O)NNC(=O)C(C)Oc2ccc(F)cc2)c(OC)c1.
What is the InChIKey of N'-[2-(2,4-dimethoxyphenyl)acetyl]-2-(4-fluorophenoxy)propanehydrazide?
The InChIKey is AMJIXRFEICCUGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O5/c1-12(27-15-8-5-14(20)6-9-15)19(24)22-21-18(23)10-13-4-7-16(25-2)11-17(13)26-3/h4-9,11-12H,10H2,1-3H3,(H,21,23)(H,22,24).
What are the key properties of N'-[2-(2,4-dimethoxyphenyl)acetyl]-2-(4-fluorophenoxy)propanehydrazide?
N'-[2-(2,4-dimethoxyphenyl)acetyl]-2-(4-fluorophenoxy)propanehydrazide has a molecular weight of 376.38 g/mol, XLogP of 2.00, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2,4-dimethoxyphenyl)acetyl]-2-(4-fluorophenoxy)propanehydrazide is sourced from PubChem (CID 46521372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).