6-fluoroquinoline-2-carbaldehyde

C10H6FNO — CID 3159605

IUPAC6-fluoroquinoline-2-carbaldehyde
SMILESO=Cc1ccc2cc(F)ccc2n1
InChIInChI=1S/C10H6FNO/c11-8-2-4-10-7(5-8)1-3-9(6-13)12-10/h1-6H
InChIKeyJDQMJKKGPXPPOJ-UHFFFAOYSA-N
MW175.16 g/mol
LogP2.19
Rot. Bonds1

About 6-fluoroquinoline-2-carbaldehyde

6-fluoroquinoline-2-carbaldehyde (PubChem CID 3159605) has the molecular formula C10H6FNO and a molecular weight of 175.16 g/mol. Its IUPAC name is 6-fluoroquinoline-2-carbaldehyde.

Molecular Properties

Compound Name6-fluoroquinoline-2-carbaldehyde
PubChem CID3159605
Molecular FormulaC10H6FNO
Molecular Weight175.16 g/mol
Exact Mass175.04
IUPAC Name6-fluoroquinoline-2-carbaldehyde
SMILESO=Cc1ccc2cc(F)ccc2n1
InChIInChI=1S/C10H6FNO/c11-8-2-4-10-7(5-8)1-3-9(6-13)12-10/h1-6H
InChIKeyJDQMJKKGPXPPOJ-UHFFFAOYSA-N
XLogP2.19
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.16
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-Quinolinecarboxamide, N-hydroxy-
CID 148031
4-Quinolinecarboxaldehyde
CID 78072
9-Acridinecarboxaldehyde
CID 98663
2-Benzoylquinoline
CID 727029
Quinoline-2-carbohydrazide
CID 246466
2-Quinolinecarboxaldehyde
CID 79619
2-Methylquinoline-4-carboxamide
CID 85122
8-Quinolinecarboxaldehyde
CID 170103
N-phenylquinoline-2-carboxamide
CID 344116
Isoquinoline-1-carbaldehyde
CID 265306
3-Quinolinecarboxaldehyde
CID 83641
2-Chloro-3-quinolinecarboxaldehyde
CID 690958

Frequently Asked Questions

What is the IUPAC name of 6-fluoroquinoline-2-carbaldehyde?
The IUPAC name of 6-fluoroquinoline-2-carbaldehyde (CID 3159605) is 6-fluoroquinoline-2-carbaldehyde.
What is the SMILES notation for 6-fluoroquinoline-2-carbaldehyde?
The canonical SMILES for 6-fluoroquinoline-2-carbaldehyde is O=Cc1ccc2cc(F)ccc2n1.
What is the InChIKey of 6-fluoroquinoline-2-carbaldehyde?
The InChIKey is JDQMJKKGPXPPOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6FNO/c11-8-2-4-10-7(5-8)1-3-9(6-13)12-10/h1-6H.
What are the key properties of 6-fluoroquinoline-2-carbaldehyde?
6-fluoroquinoline-2-carbaldehyde has a molecular weight of 175.16 g/mol, XLogP of 2.19, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoroquinoline-2-carbaldehyde is sourced from PubChem (CID 3159605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).