7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine

C7H5ClN2O3 — CID 10536056

IUPAC7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine
SMILESO=[N+]([O-])c1cc2c(c(Cl)n1)OCC2
InChIInChI=1S/C7H5ClN2O3/c8-7-6-4(1-2-13-6)3-5(9-7)10(11)12/h3H,1-2H2
InChIKeyGGJRZXQENSBZAA-UHFFFAOYSA-N
MW200.58 g/mol
LogP1.58
Rot. Bonds1

About 7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine

7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine (PubChem CID 10536056) has the molecular formula C7H5ClN2O3 and a molecular weight of 200.58 g/mol. Its IUPAC name is 7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine.

Molecular Properties

Compound Name7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine
PubChem CID10536056
Molecular FormulaC7H5ClN2O3
Molecular Weight200.58 g/mol
Exact Mass200.00
IUPAC Name7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine
SMILESO=[N+]([O-])c1cc2c(c(Cl)n1)OCC2
InChIInChI=1S/C7H5ClN2O3/c8-7-6-4(1-2-13-6)3-5(9-7)10(11)12/h3H,1-2H2
InChIKeyGGJRZXQENSBZAA-UHFFFAOYSA-N
XLogP1.58
TPSA65.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.58
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine 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 7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine?
The IUPAC name of 7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine (CID 10536056) is 7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine.
What is the SMILES notation for 7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine?
The canonical SMILES for 7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine is O=[N+]([O-])c1cc2c(c(Cl)n1)OCC2.
What is the InChIKey of 7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine?
The InChIKey is GGJRZXQENSBZAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5ClN2O3/c8-7-6-4(1-2-13-6)3-5(9-7)10(11)12/h3H,1-2H2.
What are the key properties of 7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine?
7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine has a molecular weight of 200.58 g/mol, XLogP of 1.58, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-5-nitro-2,3-dihydrofuro[2,3-c]pyridine is sourced from PubChem (CID 10536056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).