5-chlorofuro[2,3-c]pyridin-3-one

C7H4ClNO2 — CID 86721918

IUPAC5-chlorofuro[2,3-c]pyridin-3-one
SMILESO=C1COc2cnc(Cl)cc21
InChIInChI=1S/C7H4ClNO2/c8-7-1-4-5(10)3-11-6(4)2-9-7/h1-2H,3H2
InChIKeyJQTPBHMIUMGLMY-UHFFFAOYSA-N
MW169.57 g/mol
LogP1.31
Rot. Bonds

About 5-chlorofuro[2,3-c]pyridin-3-one

5-chlorofuro[2,3-c]pyridin-3-one (PubChem CID 86721918) has the molecular formula C7H4ClNO2 and a molecular weight of 169.57 g/mol. Its IUPAC name is 5-chlorofuro[2,3-c]pyridin-3-one.

Molecular Properties

Compound Name5-chlorofuro[2,3-c]pyridin-3-one
PubChem CID86721918
Molecular FormulaC7H4ClNO2
Molecular Weight169.57 g/mol
Exact Mass168.99
IUPAC Name5-chlorofuro[2,3-c]pyridin-3-one
SMILESO=C1COc2cnc(Cl)cc21
InChIInChI=1S/C7H4ClNO2/c8-7-1-4-5(10)3-11-6(4)2-9-7/h1-2H,3H2
InChIKeyJQTPBHMIUMGLMY-UHFFFAOYSA-N
XLogP1.31
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.57
LogP ≤ 51.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-chlorofuro[2,3-c]pyridin-3-one 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

7-chloro-1H-pyrido[3,4-b][1,4]oxazin-2-one
CID 55265376
3-chloro-5,6-dihydrocyclopenta[c]pyridin-7-one
CID 118142930
5,6,7,8-tetrahydrobenzo[f][1]benzofuran-3-one
CID 61398920
5-amino-1-benzofuran-3-one
CID 51138323
7-chloro-2,2-dimethyl-3H-pyrano[3,2-c]pyridin-4-one
CID 88921692
furo[3,2-c]pyridin-3-one;hydrochloride
CID 57367134
6-chloro-1,4-dihydropyrido[3,4-d][1,3]oxazin-2-one
CID 155691308
7-chloro-3H-1,6-naphthyridin-4-one
CID 125306381
6-chloro-2,3-dihydrofuro[3,2-c]pyridine
CID 10725593
5-bromo-4-(5-bromo-2-chloro-4-pyridinyl)-2-chloropyridine
CID 46220750
5-acetyl-1-benzofuran-3-one
CID 23008718
6-piperidin-1-yl-1-benzofuran-3-one
CID 59706016

Frequently Asked Questions

What is the IUPAC name of 5-chlorofuro[2,3-c]pyridin-3-one?
The IUPAC name of 5-chlorofuro[2,3-c]pyridin-3-one (CID 86721918) is 5-chlorofuro[2,3-c]pyridin-3-one.
What is the SMILES notation for 5-chlorofuro[2,3-c]pyridin-3-one?
The canonical SMILES for 5-chlorofuro[2,3-c]pyridin-3-one is O=C1COc2cnc(Cl)cc21.
What is the InChIKey of 5-chlorofuro[2,3-c]pyridin-3-one?
The InChIKey is JQTPBHMIUMGLMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4ClNO2/c8-7-1-4-5(10)3-11-6(4)2-9-7/h1-2H,3H2.
What are the key properties of 5-chlorofuro[2,3-c]pyridin-3-one?
5-chlorofuro[2,3-c]pyridin-3-one has a molecular weight of 169.57 g/mol, XLogP of 1.31, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chlorofuro[2,3-c]pyridin-3-one is sourced from PubChem (CID 86721918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).