5-[2-(2-methoxyethyl)phenyl]furan-2-carbaldehyde

C14H14O3 — CID 102907443

IUPAC5-[2-(2-methoxyethyl)phenyl]furan-2-carbaldehyde
SMILESCOCCc1ccccc1-c1ccc(C=O)o1
InChIInChI=1S/C14H14O3/c1-16-9-8-11-4-2-3-5-13(11)14-7-6-12(10-15)17-14/h2-7,10H,8-9H2,1H3
InChIKeyQWIOVMPSZPZHJE-UHFFFAOYSA-N
MW230.26 g/mol
LogP2.95
Rot. Bonds5

About 5-[2-(2-methoxyethyl)phenyl]furan-2-carbaldehyde

5-[2-(2-methoxyethyl)phenyl]furan-2-carbaldehyde (PubChem CID 102907443) has the molecular formula C14H14O3 and a molecular weight of 230.26 g/mol. Its IUPAC name is 5-[2-(2-methoxyethyl)phenyl]furan-2-carbaldehyde.

Molecular Properties

Compound Name5-[2-(2-methoxyethyl)phenyl]furan-2-carbaldehyde
PubChem CID102907443
Molecular FormulaC14H14O3
Molecular Weight230.26 g/mol
Exact Mass230.09
IUPAC Name5-[2-(2-methoxyethyl)phenyl]furan-2-carbaldehyde
SMILESCOCCc1ccccc1-c1ccc(C=O)o1
InChIInChI=1S/C14H14O3/c1-16-9-8-11-4-2-3-5-13(11)14-7-6-12(10-15)17-14/h2-7,10H,8-9H2,1H3
InChIKeyQWIOVMPSZPZHJE-UHFFFAOYSA-N
XLogP2.95
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 52.95
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

[5-[2-(2-methoxyethyl)phenyl]furan-2-yl]methanamine
CID 102907457
1-[5-[2-(2-methoxyethyl)phenyl]furan-2-yl]-N-methylethanamine
CID 102907450
5-[2-(3-methoxyphenyl)phenyl]furan-2-carbaldehyde
CID 58838892
5-(2-butan-2-yloxyphenyl)furan-2-carbaldehyde
CID 169332268
5-[4-(2-methoxyphenyl)phenyl]furan-2-carbaldehyde
CID 169332736
2-[2-amino-3-(2-methoxyethyl)phenyl]benzaldehyde
CID 154402292
5-[2-(4,5-dimethyl-1,3-oxazol-2-yl)phenyl]furan-2-carbaldehyde
CID 169334656
2-oxopropyl 2-(5-formylfuran-2-yl)benzoate
CID 169334646
5-(4-methylnaphthalen-1-yl)furan-2-carbaldehyde
CID 106888456
2-(5-formylfuran-2-yl)-N-[(4-methoxyphenyl)methyl]benzamide
CID 169335250
2-methylpropyl 2-(5-formylfuran-2-yl)benzoate
CID 169331925
2-(5-formylfuran-2-yl)-N,N-dimethylbenzamide
CID 169332033

Frequently Asked Questions

What is the IUPAC name of 5-[2-(2-methoxyethyl)phenyl]furan-2-carbaldehyde?
The IUPAC name of 5-[2-(2-methoxyethyl)phenyl]furan-2-carbaldehyde (CID 102907443) is 5-[2-(2-methoxyethyl)phenyl]furan-2-carbaldehyde.
What is the SMILES notation for 5-[2-(2-methoxyethyl)phenyl]furan-2-carbaldehyde?
The canonical SMILES for 5-[2-(2-methoxyethyl)phenyl]furan-2-carbaldehyde is COCCc1ccccc1-c1ccc(C=O)o1.
What is the InChIKey of 5-[2-(2-methoxyethyl)phenyl]furan-2-carbaldehyde?
The InChIKey is QWIOVMPSZPZHJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O3/c1-16-9-8-11-4-2-3-5-13(11)14-7-6-12(10-15)17-14/h2-7,10H,8-9H2,1H3.
What are the key properties of 5-[2-(2-methoxyethyl)phenyl]furan-2-carbaldehyde?
5-[2-(2-methoxyethyl)phenyl]furan-2-carbaldehyde has a molecular weight of 230.26 g/mol, XLogP of 2.95, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(2-methoxyethyl)phenyl]furan-2-carbaldehyde is sourced from PubChem (CID 102907443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).