5-(3-azidoprop-1-enyl)-2-fluoropyridine

C8H7FN4 — CID 169461269

IUPAC5-(3-azidoprop-1-enyl)-2-fluoropyridine
SMILES[N-]=[N+]=NCC=Cc1ccc(F)nc1
InChIInChI=1S/C8H7FN4/c9-8-4-3-7(6-11-8)2-1-5-12-13-10/h1-4,6H,5H2
InChIKeyBBBFGZXGVPDTFV-UHFFFAOYSA-N
MW178.17 g/mol
LogP2.54
Rot. Bonds3

About 5-(3-azidoprop-1-enyl)-2-fluoropyridine

5-(3-azidoprop-1-enyl)-2-fluoropyridine (PubChem CID 169461269) has the molecular formula C8H7FN4 and a molecular weight of 178.17 g/mol. Its IUPAC name is 5-(3-azidoprop-1-enyl)-2-fluoropyridine.

Molecular Properties

Compound Name5-(3-azidoprop-1-enyl)-2-fluoropyridine
PubChem CID169461269
Molecular FormulaC8H7FN4
Molecular Weight178.17 g/mol
Exact Mass178.07
IUPAC Name5-(3-azidoprop-1-enyl)-2-fluoropyridine
SMILES[N-]=[N+]=NCC=Cc1ccc(F)nc1
InChIInChI=1S/C8H7FN4/c9-8-4-3-7(6-11-8)2-1-5-12-13-10/h1-4,6H,5H2
InChIKeyBBBFGZXGVPDTFV-UHFFFAOYSA-N
XLogP2.54
TPSA61.65 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.17
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

Analyze 5-(3-azidoprop-1-enyl)-2-fluoropyridine with MolForge

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

Launch Full Analysis

Related Compounds

[5-(3-azidoprop-1-enyl)-2-pyridinyl]methanol
CID 169461523
1-(3-azidoprop-1-enyl)-4-chlorobenzene
CID 141280694
5-(3-bromoprop-1-enyl)-2-fluoropyridine
CID 169474982
4-(6-fluoro-3-pyridinyl)but-3-enal
CID 170481333
4-(3-azidoprop-1-enyl)benzene-1,2-diamine
CID 169461436
1-(3-azidoprop-1-enyl)-4-ethoxybenzene
CID 151962679
4-(3-azidoprop-1-enyl)-1,2-dimethylbenzene
CID 150434648
4-(3-azidoprop-1-enyl)-2-fluorobenzonitrile
CID 169461754
5-(3-azidoprop-1-enyl)-2-methylpyridin-3-amine
CID 169461419
4-[2-(6-fluoro-3-pyridinyl)ethenyl]aniline
CID 67482043
2-[5-(3-azidoprop-1-enyl)-2-fluorophenyl]acetonitrile
CID 169462095
6-(3-azidoprop-1-enyl)-1H-pyrazolo[4,5-b]pyridine
CID 169461887

Frequently Asked Questions

What is the IUPAC name of 5-(3-azidoprop-1-enyl)-2-fluoropyridine?
The IUPAC name of 5-(3-azidoprop-1-enyl)-2-fluoropyridine (CID 169461269) is 5-(3-azidoprop-1-enyl)-2-fluoropyridine.
What is the SMILES notation for 5-(3-azidoprop-1-enyl)-2-fluoropyridine?
The canonical SMILES for 5-(3-azidoprop-1-enyl)-2-fluoropyridine is [N-]=[N+]=NCC=Cc1ccc(F)nc1.
What is the InChIKey of 5-(3-azidoprop-1-enyl)-2-fluoropyridine?
The InChIKey is BBBFGZXGVPDTFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7FN4/c9-8-4-3-7(6-11-8)2-1-5-12-13-10/h1-4,6H,5H2.
What are the key properties of 5-(3-azidoprop-1-enyl)-2-fluoropyridine?
5-(3-azidoprop-1-enyl)-2-fluoropyridine has a molecular weight of 178.17 g/mol, XLogP of 2.54, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-azidoprop-1-enyl)-2-fluoropyridine is sourced from PubChem (CID 169461269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).