5-chlorofuro[2,3-c]pyridine-2-carbaldehyde

C8H4ClNO2 — CID 82408054

IUPAC5-chlorofuro[2,3-c]pyridine-2-carbaldehyde
SMILESO=Cc1cc2cc(Cl)ncc2o1
InChIInChI=1S/C8H4ClNO2/c9-8-2-5-1-6(4-11)12-7(5)3-10-8/h1-4H
InChIKeyDCTCRCCQDMMJTD-UHFFFAOYSA-N
MW181.58 g/mol
LogP2.29
Rot. Bonds1

About 5-chlorofuro[2,3-c]pyridine-2-carbaldehyde

5-chlorofuro[2,3-c]pyridine-2-carbaldehyde (PubChem CID 82408054) has the molecular formula C8H4ClNO2 and a molecular weight of 181.58 g/mol. Its IUPAC name is 5-chlorofuro[2,3-c]pyridine-2-carbaldehyde.

Molecular Properties

Compound Name5-chlorofuro[2,3-c]pyridine-2-carbaldehyde
PubChem CID82408054
Molecular FormulaC8H4ClNO2
Molecular Weight181.58 g/mol
Exact Mass180.99
IUPAC Name5-chlorofuro[2,3-c]pyridine-2-carbaldehyde
SMILESO=Cc1cc2cc(Cl)ncc2o1
InChIInChI=1S/C8H4ClNO2/c9-8-2-5-1-6(4-11)12-7(5)3-10-8/h1-4H
InChIKeyDCTCRCCQDMMJTD-UHFFFAOYSA-N
XLogP2.29
TPSA43.10 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.58
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-Chlorofuro[3,2-c]pyridine-2-carbaldehyde
CID 343182
Furo(2,3-c)pyridine-2-carbaldehyde
CID 642129
5-Acetylfuro(2,3-c)pyridine
CID 9793902
Furo[2,3-c]pyridine-2-carboxylic acid
CID 13803072
Ethyl furo(2,3-c)pyridine-2-carboxylate
CID 642130
7-(2,4-Difluorophenoxy)furo[2,3-c]pyridine
CID 90645318
7-Chlorofuro[2,3-c]pyridine
CID 12826107
5-Chlorofuro(2,3-b)pyridine-2-carbaldehyde
CID 50988855
Ethyl 4-chlorofuro[2,3-c]pyridine-2-carboxylate
CID 58622544
7-Chlorofuro(2,3-c)pyridine-2-carbaldehyde
CID 82408055
5-Chlorofuro[2,3-c]pyridine-2-carboxylic acid
CID 84014751
Methyl 5-chlorofuro(2,3-c)pyridine-2-carboxylate
CID 89784815

Frequently Asked Questions

What is the IUPAC name of 5-chlorofuro[2,3-c]pyridine-2-carbaldehyde?
The IUPAC name of 5-chlorofuro[2,3-c]pyridine-2-carbaldehyde (CID 82408054) is 5-chlorofuro[2,3-c]pyridine-2-carbaldehyde.
What is the SMILES notation for 5-chlorofuro[2,3-c]pyridine-2-carbaldehyde?
The canonical SMILES for 5-chlorofuro[2,3-c]pyridine-2-carbaldehyde is O=Cc1cc2cc(Cl)ncc2o1.
What is the InChIKey of 5-chlorofuro[2,3-c]pyridine-2-carbaldehyde?
The InChIKey is DCTCRCCQDMMJTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4ClNO2/c9-8-2-5-1-6(4-11)12-7(5)3-10-8/h1-4H.
What are the key properties of 5-chlorofuro[2,3-c]pyridine-2-carbaldehyde?
5-chlorofuro[2,3-c]pyridine-2-carbaldehyde has a molecular weight of 181.58 g/mol, XLogP of 2.29, 1 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]pyridine-2-carbaldehyde is sourced from PubChem (CID 82408054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).