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

C18H16FN3O2 — CID 31772931

IUPAC2-(3-fluorophenyl)-N'-[2-(1H-indol-3-yl)acetyl]acetohydrazide
SMILESO=C(Cc1cccc(F)c1)NNC(=O)Cc1c[nH]c2ccccc12
InChIInChI=1S/C18H16FN3O2/c19-14-5-3-4-12(8-14)9-17(23)21-22-18(24)10-13-11-20-16-7-2-1-6-15(13)16/h1-8,11,20H,9-10H2,(H,21,23)(H,22,24)
InChIKeyHWBVAVUSYVCFBV-UHFFFAOYSA-N
MW325.34 g/mol
LogP2.24
Rot. Bonds4

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

2-(3-fluorophenyl)-N'-[2-(1H-indol-3-yl)acetyl]acetohydrazide (PubChem CID 31772931) has the molecular formula C18H16FN3O2 and a molecular weight of 325.34 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-N'-[2-(1H-indol-3-yl)acetyl]acetohydrazide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-N'-[2-(1H-indol-3-yl)acetyl]acetohydrazide
PubChem CID31772931
Molecular FormulaC18H16FN3O2
Molecular Weight325.34 g/mol
Exact Mass325.12
IUPAC Name2-(3-fluorophenyl)-N'-[2-(1H-indol-3-yl)acetyl]acetohydrazide
SMILESO=C(Cc1cccc(F)c1)NNC(=O)Cc1c[nH]c2ccccc12
InChIInChI=1S/C18H16FN3O2/c19-14-5-3-4-12(8-14)9-17(23)21-22-18(24)10-13-11-20-16-7-2-1-6-15(13)16/h1-8,11,20H,9-10H2,(H,21,23)(H,22,24)
InChIKeyHWBVAVUSYVCFBV-UHFFFAOYSA-N
XLogP2.24
TPSA73.99 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.34
LogP ≤ 52.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(3-fluorophenyl)-1-(1H-indol-3-yl)ethanone
CID 43339255
N'-[2-(2,4-difluorophenoxy)acetyl]-2-(1H-indol-3-yl)acetohydrazide
CID 31905428
N'-[2-(4-fluorophenoxy)acetyl]-2-(1H-indol-3-yl)acetohydrazide
CID 26932809
2-(1H-indol-3-yl)-N'-(2-phenylmethoxyacetyl)acetohydrazide
CID 102603627
3-(3,4-difluorophenyl)-N'-[2-(1H-indol-3-yl)acetyl]propanehydrazide
CID 55616581
3-(4-fluorophenyl)sulfanyl-N'-[2-(1H-indol-3-yl)acetyl]propanehydrazide
CID 17485569
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-(5-fluoro-1H-indol-3-yl)ethyl]-2-(3-fluorophenyl)acetamide
CID 110731491
2-bromo-5-fluoro-N-[3-[2-[2-(1H-indol-3-yl)acetyl]hydrazinyl]-3-oxopropyl]benzamide
CID 55822838
1-[[2-(1H-indol-3-yl)acetyl]amino]-3-phenylurea
CID 5058781
2-(3-fluorophenyl)-N-[2-[2-[2-(4-fluorophenyl)acetyl]hydrazinyl]-2-oxoethyl]acetamide
CID 55789223

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-N'-[2-(1H-indol-3-yl)acetyl]acetohydrazide?
The IUPAC name of 2-(3-fluorophenyl)-N'-[2-(1H-indol-3-yl)acetyl]acetohydrazide (CID 31772931) is 2-(3-fluorophenyl)-N'-[2-(1H-indol-3-yl)acetyl]acetohydrazide.
What is the SMILES notation for 2-(3-fluorophenyl)-N'-[2-(1H-indol-3-yl)acetyl]acetohydrazide?
The canonical SMILES for 2-(3-fluorophenyl)-N'-[2-(1H-indol-3-yl)acetyl]acetohydrazide is O=C(Cc1cccc(F)c1)NNC(=O)Cc1c[nH]c2ccccc12.
What is the InChIKey of 2-(3-fluorophenyl)-N'-[2-(1H-indol-3-yl)acetyl]acetohydrazide?
The InChIKey is HWBVAVUSYVCFBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FN3O2/c19-14-5-3-4-12(8-14)9-17(23)21-22-18(24)10-13-11-20-16-7-2-1-6-15(13)16/h1-8,11,20H,9-10H2,(H,21,23)(H,22,24).
What are the key properties of 2-(3-fluorophenyl)-N'-[2-(1H-indol-3-yl)acetyl]acetohydrazide?
2-(3-fluorophenyl)-N'-[2-(1H-indol-3-yl)acetyl]acetohydrazide has a molecular weight of 325.34 g/mol, XLogP of 2.24, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-N'-[2-(1H-indol-3-yl)acetyl]acetohydrazide is sourced from PubChem (CID 31772931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).