7-propan-2-ylfuro[3,2-c]pyridine-2-carbaldehyde

C11H11NO2 — CID 82404749

IUPAC7-propan-2-ylfuro[3,2-c]pyridine-2-carbaldehyde
SMILESCC(C)c1cncc2cc(C=O)oc12
InChIInChI=1S/C11H11NO2/c1-7(2)10-5-12-4-8-3-9(6-13)14-11(8)10/h3-7H,1-2H3
InChIKeyQZXLUSNDFNWNMI-UHFFFAOYSA-N
MW189.21 g/mol
LogP2.76
Rot. Bonds2

About 7-propan-2-ylfuro[3,2-c]pyridine-2-carbaldehyde

7-propan-2-ylfuro[3,2-c]pyridine-2-carbaldehyde (PubChem CID 82404749) has the molecular formula C11H11NO2 and a molecular weight of 189.21 g/mol. Its IUPAC name is 7-propan-2-ylfuro[3,2-c]pyridine-2-carbaldehyde.

Molecular Properties

Compound Name7-propan-2-ylfuro[3,2-c]pyridine-2-carbaldehyde
PubChem CID82404749
Molecular FormulaC11H11NO2
Molecular Weight189.21 g/mol
Exact Mass189.08
IUPAC Name7-propan-2-ylfuro[3,2-c]pyridine-2-carbaldehyde
SMILESCC(C)c1cncc2cc(C=O)oc12
InChIInChI=1S/C11H11NO2/c1-7(2)10-5-12-4-8-3-9(6-13)14-11(8)10/h3-7H,1-2H3
InChIKeyQZXLUSNDFNWNMI-UHFFFAOYSA-N
XLogP2.76
TPSA43.10 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 7-propan-2-ylfuro[3,2-c]pyridine-2-carbaldehyde?
The IUPAC name of 7-propan-2-ylfuro[3,2-c]pyridine-2-carbaldehyde (CID 82404749) is 7-propan-2-ylfuro[3,2-c]pyridine-2-carbaldehyde.
What is the SMILES notation for 7-propan-2-ylfuro[3,2-c]pyridine-2-carbaldehyde?
The canonical SMILES for 7-propan-2-ylfuro[3,2-c]pyridine-2-carbaldehyde is CC(C)c1cncc2cc(C=O)oc12.
What is the InChIKey of 7-propan-2-ylfuro[3,2-c]pyridine-2-carbaldehyde?
The InChIKey is QZXLUSNDFNWNMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2/c1-7(2)10-5-12-4-8-3-9(6-13)14-11(8)10/h3-7H,1-2H3.
What are the key properties of 7-propan-2-ylfuro[3,2-c]pyridine-2-carbaldehyde?
7-propan-2-ylfuro[3,2-c]pyridine-2-carbaldehyde has a molecular weight of 189.21 g/mol, XLogP of 2.76, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-propan-2-ylfuro[3,2-c]pyridine-2-carbaldehyde is sourced from PubChem (CID 82404749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).