2-chloro-5,7-dihydrofuro[3,4-b]pyridine

C7H6ClNO — CID 71743630

IUPAC2-chloro-5,7-dihydrofuro[3,4-b]pyridine
SMILESClc1ccc2c(n1)COC2
InChIInChI=1S/C7H6ClNO/c8-7-2-1-5-3-10-4-6(5)9-7/h1-2H,3-4H2
InChIKeyHGLLKIPTUBJJAC-UHFFFAOYSA-N
MW155.58 g/mol
LogP1.77
Rot. Bonds

About 2-chloro-5,7-dihydrofuro[3,4-b]pyridine

2-chloro-5,7-dihydrofuro[3,4-b]pyridine (PubChem CID 71743630) has the molecular formula C7H6ClNO and a molecular weight of 155.58 g/mol. Its IUPAC name is 2-chloro-5,7-dihydrofuro[3,4-b]pyridine.

Molecular Properties

Compound Name2-chloro-5,7-dihydrofuro[3,4-b]pyridine
PubChem CID71743630
Molecular FormulaC7H6ClNO
Molecular Weight155.58 g/mol
Exact Mass155.01
IUPAC Name2-chloro-5,7-dihydrofuro[3,4-b]pyridine
SMILESClc1ccc2c(n1)COC2
InChIInChI=1S/C7H6ClNO/c8-7-2-1-5-3-10-4-6(5)9-7/h1-2H,3-4H2
InChIKeyHGLLKIPTUBJJAC-UHFFFAOYSA-N
XLogP1.77
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.58
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-Chloro-6-(oxiran-2-yl)pyridine
CID 15067150
2-chloro-5H,7H,8H-pyrano[4,3-b]pyridine
CID 71743618
2-chloro-5H,6H,8H-pyrano[3,4-b]pyridine
CID 83827163
2-chloro-5H,7H-furo[3,4-b]pyridin-5-one
CID 165123008
2-chloro-5H,7H-furo(3,4-b)pyridine-3-carbonitrile
CID 82600794
2-chloro-7,7-dimethyl-5H,7H-furo(3,4-b)pyridine-3-carbonitrile
CID 130773165
5,7-Dihydrofuro[3,4-b]pyridine
CID 13556661
2-Methyl-5,7-dihydrofuro[3,4-b]pyridine
CID 14434935
(7S)-2-chloro-7-[(3-fluorophenyl)methoxy]-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 57597040
2-Chloro-3-(ethoxymethyl)-5-fluoro-6-methylpyridine
CID 88867112
2-Chloro-3-fluoro-6-(methoxymethyl)pyridine
CID 118497043
2-Chloro-6-(methoxymethyl)-4-(trifluoromethyl)pyridine
CID 135200908

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5,7-dihydrofuro[3,4-b]pyridine?
The IUPAC name of 2-chloro-5,7-dihydrofuro[3,4-b]pyridine (CID 71743630) is 2-chloro-5,7-dihydrofuro[3,4-b]pyridine.
What is the SMILES notation for 2-chloro-5,7-dihydrofuro[3,4-b]pyridine?
The canonical SMILES for 2-chloro-5,7-dihydrofuro[3,4-b]pyridine is Clc1ccc2c(n1)COC2.
What is the InChIKey of 2-chloro-5,7-dihydrofuro[3,4-b]pyridine?
The InChIKey is HGLLKIPTUBJJAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClNO/c8-7-2-1-5-3-10-4-6(5)9-7/h1-2H,3-4H2.
What are the key properties of 2-chloro-5,7-dihydrofuro[3,4-b]pyridine?
2-chloro-5,7-dihydrofuro[3,4-b]pyridine has a molecular weight of 155.58 g/mol, XLogP of 1.77, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5,7-dihydrofuro[3,4-b]pyridine is sourced from PubChem (CID 71743630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).