N'-[4-amino-2-(2-fluorophenyl)quinolin-6-yl]acetohydrazide

C17H15FN4O — CID 18439821

IUPACN'-[4-amino-2-(2-fluorophenyl)quinolin-6-yl]acetohydrazide
SMILESCC(=O)NNc1ccc2nc(-c3ccccc3F)cc(N)c2c1
InChIInChI=1S/C17H15FN4O/c1-10(23)21-22-11-6-7-16-13(8-11)15(19)9-17(20-16)12-4-2-3-5-14(12)18/h2-9,22H,1H3,(H2,19,20)(H,21,23)
InChIKeyKSMCUQKNAWYIEV-UHFFFAOYSA-N
MW310.33 g/mol
LogP3.09
Rot. Bonds3

About N'-[4-amino-2-(2-fluorophenyl)quinolin-6-yl]acetohydrazide

N'-[4-amino-2-(2-fluorophenyl)quinolin-6-yl]acetohydrazide (PubChem CID 18439821) has the molecular formula C17H15FN4O and a molecular weight of 310.33 g/mol. Its IUPAC name is N'-[4-amino-2-(2-fluorophenyl)quinolin-6-yl]acetohydrazide.

Molecular Properties

Compound NameN'-[4-amino-2-(2-fluorophenyl)quinolin-6-yl]acetohydrazide
PubChem CID18439821
Molecular FormulaC17H15FN4O
Molecular Weight310.33 g/mol
Exact Mass310.12
IUPAC NameN'-[4-amino-2-(2-fluorophenyl)quinolin-6-yl]acetohydrazide
SMILESCC(=O)NNc1ccc2nc(-c3ccccc3F)cc(N)c2c1
InChIInChI=1S/C17H15FN4O/c1-10(23)21-22-11-6-7-16-13(8-11)15(19)9-17(20-16)12-4-2-3-5-14(12)18/h2-9,22H,1H3,(H2,19,20)(H,21,23)
InChIKeyKSMCUQKNAWYIEV-UHFFFAOYSA-N
XLogP3.09
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.33
LogP ≤ 53.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N'-[4-amino-2-(2-fluorophenyl)quinolin-6-yl]acetohydrazide 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 N'-[4-amino-2-(2-fluorophenyl)quinolin-6-yl]acetohydrazide?
The IUPAC name of N'-[4-amino-2-(2-fluorophenyl)quinolin-6-yl]acetohydrazide (CID 18439821) is N'-[4-amino-2-(2-fluorophenyl)quinolin-6-yl]acetohydrazide.
What is the SMILES notation for N'-[4-amino-2-(2-fluorophenyl)quinolin-6-yl]acetohydrazide?
The canonical SMILES for N'-[4-amino-2-(2-fluorophenyl)quinolin-6-yl]acetohydrazide is CC(=O)NNc1ccc2nc(-c3ccccc3F)cc(N)c2c1.
What is the InChIKey of N'-[4-amino-2-(2-fluorophenyl)quinolin-6-yl]acetohydrazide?
The InChIKey is KSMCUQKNAWYIEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN4O/c1-10(23)21-22-11-6-7-16-13(8-11)15(19)9-17(20-16)12-4-2-3-5-14(12)18/h2-9,22H,1H3,(H2,19,20)(H,21,23).
What are the key properties of N'-[4-amino-2-(2-fluorophenyl)quinolin-6-yl]acetohydrazide?
N'-[4-amino-2-(2-fluorophenyl)quinolin-6-yl]acetohydrazide has a molecular weight of 310.33 g/mol, XLogP of 3.09, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[4-amino-2-(2-fluorophenyl)quinolin-6-yl]acetohydrazide is sourced from PubChem (CID 18439821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).