8-fluoro-7-methoxyquinoline-2-carbaldehyde

C11H8FNO2 — CID 89158464

IUPAC8-fluoro-7-methoxyquinoline-2-carbaldehyde
SMILESCOc1ccc2ccc(C=O)nc2c1F
InChIInChI=1S/C11H8FNO2/c1-15-9-5-3-7-2-4-8(6-14)13-11(7)10(9)12/h2-6H,1H3
InChIKeyZJEANOWNLYAYNP-UHFFFAOYSA-N
MW205.19 g/mol
LogP2.19
Rot. Bonds2

About 8-fluoro-7-methoxyquinoline-2-carbaldehyde

8-fluoro-7-methoxyquinoline-2-carbaldehyde (PubChem CID 89158464) has the molecular formula C11H8FNO2 and a molecular weight of 205.19 g/mol. Its IUPAC name is 8-fluoro-7-methoxyquinoline-2-carbaldehyde.

Molecular Properties

Compound Name8-fluoro-7-methoxyquinoline-2-carbaldehyde
PubChem CID89158464
Molecular FormulaC11H8FNO2
Molecular Weight205.19 g/mol
Exact Mass205.05
IUPAC Name8-fluoro-7-methoxyquinoline-2-carbaldehyde
SMILESCOc1ccc2ccc(C=O)nc2c1F
InChIInChI=1S/C11H8FNO2/c1-15-9-5-3-7-2-4-8(6-14)13-11(7)10(9)12/h2-6H,1H3
InChIKeyZJEANOWNLYAYNP-UHFFFAOYSA-N
XLogP2.19
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.19
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-ethenyl-5-methoxypyridine-2-carbaldehyde
CID 74891018
8-(2-methoxyethoxy)quinoline-2-carbaldehyde
CID 150689911
4-(8-fluoro-7-methoxyquinolin-2-yl)-2-propan-2-yl-1,3-thiazole
CID 91438319
(2R)-2-amino-2-(6-formyl-3-methoxy-2-pyridinyl)acetic acid
CID 123382658
4,8-dimethoxyquinoline-2-carbaldehyde
CID 23125776
7-methoxyisoquinoline-8-carbaldehyde
CID 82573729
2-(2-fluoro-3-methoxyphenyl)-4,5-dimethoxybenzaldehyde
CID 82791666
8-fluoro-5-methoxyquinoline-4-carbaldehyde
CID 172633663
4-(2,3-difluoro-4-methoxyphenyl)benzaldehyde
CID 144969645
5,8-dimethoxy-2-methylquinoline-3-carbaldehyde
CID 15672393
2,4-diaminopyrido[3,2-d]pyrimidine-6-carbaldehyde
CID 71318701
5-fluoro-2-(2-fluoro-3-methoxyphenyl)pyridine-4-carbaldehyde
CID 172868912

Frequently Asked Questions

What is the IUPAC name of 8-fluoro-7-methoxyquinoline-2-carbaldehyde?
The IUPAC name of 8-fluoro-7-methoxyquinoline-2-carbaldehyde (CID 89158464) is 8-fluoro-7-methoxyquinoline-2-carbaldehyde.
What is the SMILES notation for 8-fluoro-7-methoxyquinoline-2-carbaldehyde?
The canonical SMILES for 8-fluoro-7-methoxyquinoline-2-carbaldehyde is COc1ccc2ccc(C=O)nc2c1F.
What is the InChIKey of 8-fluoro-7-methoxyquinoline-2-carbaldehyde?
The InChIKey is ZJEANOWNLYAYNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8FNO2/c1-15-9-5-3-7-2-4-8(6-14)13-11(7)10(9)12/h2-6H,1H3.
What are the key properties of 8-fluoro-7-methoxyquinoline-2-carbaldehyde?
8-fluoro-7-methoxyquinoline-2-carbaldehyde has a molecular weight of 205.19 g/mol, XLogP of 2.19, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-7-methoxyquinoline-2-carbaldehyde is sourced from PubChem (CID 89158464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).