5-fluoro-1H-indole-2-carbohydrazide

C9H8FN3O — CID 2728177

IUPAC5-fluoro-1H-indole-2-carbohydrazide
SMILESNNC(=O)c1cc2cc(F)ccc2[nH]1
InChIInChI=1S/C9H8FN3O/c10-6-1-2-7-5(3-6)4-8(12-7)9(14)13-11/h1-4,12H,11H2,(H,13,14)
InChIKeyIUDHWGKGJUROAJ-UHFFFAOYSA-N
MW193.18 g/mol
LogP0.91
Rot. Bonds1

About 5-fluoro-1H-indole-2-carbohydrazide

5-fluoro-1H-indole-2-carbohydrazide (PubChem CID 2728177) has the molecular formula C9H8FN3O and a molecular weight of 193.18 g/mol. Its IUPAC name is 5-fluoro-1H-indole-2-carbohydrazide.

Molecular Properties

Compound Name5-fluoro-1H-indole-2-carbohydrazide
PubChem CID2728177
Molecular FormulaC9H8FN3O
Molecular Weight193.18 g/mol
Exact Mass193.07
IUPAC Name5-fluoro-1H-indole-2-carbohydrazide
SMILESNNC(=O)c1cc2cc(F)ccc2[nH]1
InChIInChI=1S/C9H8FN3O/c10-6-1-2-7-5(3-6)4-8(12-7)9(14)13-11/h1-4,12H,11H2,(H,13,14)
InChIKeyIUDHWGKGJUROAJ-UHFFFAOYSA-N
XLogP0.91
TPSA70.91 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.18
LogP ≤ 50.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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'}

Analyze 5-fluoro-1H-indole-2-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1H-indole-2-carbohydrazide?
The IUPAC name of 5-fluoro-1H-indole-2-carbohydrazide (CID 2728177) is 5-fluoro-1H-indole-2-carbohydrazide.
What is the SMILES notation for 5-fluoro-1H-indole-2-carbohydrazide?
The canonical SMILES for 5-fluoro-1H-indole-2-carbohydrazide is NNC(=O)c1cc2cc(F)ccc2[nH]1.
What is the InChIKey of 5-fluoro-1H-indole-2-carbohydrazide?
The InChIKey is IUDHWGKGJUROAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FN3O/c10-6-1-2-7-5(3-6)4-8(12-7)9(14)13-11/h1-4,12H,11H2,(H,13,14).
What are the key properties of 5-fluoro-1H-indole-2-carbohydrazide?
5-fluoro-1H-indole-2-carbohydrazide has a molecular weight of 193.18 g/mol, XLogP of 0.91, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1H-indole-2-carbohydrazide is sourced from PubChem (CID 2728177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).