N'-[2-(4-fluorophenoxy)acetyl]-2-(1H-indol-3-yl)acetohydrazide

C18H16FN3O3 — CID 26932809

IUPACN'-[2-(4-fluorophenoxy)acetyl]-2-(1H-indol-3-yl)acetohydrazide
SMILESO=C(COc1ccc(F)cc1)NNC(=O)Cc1c[nH]c2ccccc12
InChIInChI=1S/C18H16FN3O3/c19-13-5-7-14(8-6-13)25-11-18(24)22-21-17(23)9-12-10-20-16-4-2-1-3-15(12)16/h1-8,10,20H,9,11H2,(H,21,23)(H,22,24)
InChIKeyBZXVQTPLZUOPIH-UHFFFAOYSA-N
MW341.34 g/mol
LogP2.08
Rot. Bonds5

About N'-[2-(4-fluorophenoxy)acetyl]-2-(1H-indol-3-yl)acetohydrazide

N'-[2-(4-fluorophenoxy)acetyl]-2-(1H-indol-3-yl)acetohydrazide (PubChem CID 26932809) has the molecular formula C18H16FN3O3 and a molecular weight of 341.34 g/mol. Its IUPAC name is N'-[2-(4-fluorophenoxy)acetyl]-2-(1H-indol-3-yl)acetohydrazide.

Molecular Properties

Compound NameN'-[2-(4-fluorophenoxy)acetyl]-2-(1H-indol-3-yl)acetohydrazide
PubChem CID26932809
Molecular FormulaC18H16FN3O3
Molecular Weight341.34 g/mol
Exact Mass341.12
IUPAC NameN'-[2-(4-fluorophenoxy)acetyl]-2-(1H-indol-3-yl)acetohydrazide
SMILESO=C(COc1ccc(F)cc1)NNC(=O)Cc1c[nH]c2ccccc12
InChIInChI=1S/C18H16FN3O3/c19-13-5-7-14(8-6-13)25-11-18(24)22-21-17(23)9-12-10-20-16-4-2-1-3-15(12)16/h1-8,10,20H,9,11H2,(H,21,23)(H,22,24)
InChIKeyBZXVQTPLZUOPIH-UHFFFAOYSA-N
XLogP2.08
TPSA83.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.34
LogP ≤ 52.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(2,4-difluorophenoxy)acetyl]-2-(1H-indol-3-yl)acetohydrazide
CID 31905428
2-(1H-indol-3-yl)-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide
CID 26901683
N-[4-(4-fluorophenoxy)butyl]-2-(1H-indol-3-yl)acetamide
CID 17405014
2-(3-fluorophenyl)-N'-[2-(1H-indol-3-yl)acetyl]acetohydrazide
CID 31772931
3-(4-fluorophenyl)sulfanyl-N'-[2-(1H-indol-3-yl)acetyl]propanehydrazide
CID 17485569
2-(1H-indol-3-yl)-N'-(2-phenylmethoxyacetyl)acetohydrazide
CID 102603627
N'-[2-(1H-indol-3-yl)acetyl]-2-(phenoxymethyl)benzohydrazide
CID 24517687
N'-[2-(2,5-dichlorophenoxy)acetyl]-2-(1H-indol-3-yl)acetohydrazide
CID 24563218
2-(1H-indol-3-yl)-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]acetamide
CID 38738127
4-(1H-indol-3-yl)-N'-[2-(1H-indol-3-yl)acetyl]butanehydrazide
CID 29437828
N-hydroxy-2-(1H-indol-3-yl)acetamide
CID 13058633
N'-[2-(4-ethoxyphenoxy)acetyl]-1H-indole-3-carbohydrazide
CID 30455658

Frequently Asked Questions

What is the IUPAC name of N'-[2-(4-fluorophenoxy)acetyl]-2-(1H-indol-3-yl)acetohydrazide?
The IUPAC name of N'-[2-(4-fluorophenoxy)acetyl]-2-(1H-indol-3-yl)acetohydrazide (CID 26932809) is N'-[2-(4-fluorophenoxy)acetyl]-2-(1H-indol-3-yl)acetohydrazide.
What is the SMILES notation for N'-[2-(4-fluorophenoxy)acetyl]-2-(1H-indol-3-yl)acetohydrazide?
The canonical SMILES for N'-[2-(4-fluorophenoxy)acetyl]-2-(1H-indol-3-yl)acetohydrazide is O=C(COc1ccc(F)cc1)NNC(=O)Cc1c[nH]c2ccccc12.
What is the InChIKey of N'-[2-(4-fluorophenoxy)acetyl]-2-(1H-indol-3-yl)acetohydrazide?
The InChIKey is BZXVQTPLZUOPIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FN3O3/c19-13-5-7-14(8-6-13)25-11-18(24)22-21-17(23)9-12-10-20-16-4-2-1-3-15(12)16/h1-8,10,20H,9,11H2,(H,21,23)(H,22,24).
What are the key properties of N'-[2-(4-fluorophenoxy)acetyl]-2-(1H-indol-3-yl)acetohydrazide?
N'-[2-(4-fluorophenoxy)acetyl]-2-(1H-indol-3-yl)acetohydrazide has a molecular weight of 341.34 g/mol, XLogP of 2.08, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(4-fluorophenoxy)acetyl]-2-(1H-indol-3-yl)acetohydrazide is sourced from PubChem (CID 26932809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).