5-(2-cyclobutylphenyl)furan-2-carbaldehyde

C15H14O2 — CID 106886627

IUPAC5-(2-cyclobutylphenyl)furan-2-carbaldehyde
SMILESO=Cc1ccc(-c2ccccc2C2CCC2)o1
InChIInChI=1S/C15H14O2/c16-10-12-8-9-15(17-12)14-7-2-1-6-13(14)11-4-3-5-11/h1-2,6-11H,3-5H2
InChIKeyCRJRBFSRVIDXHW-UHFFFAOYSA-N
MW226.28 g/mol
LogP4.03
Rot. Bonds3

About 5-(2-cyclobutylphenyl)furan-2-carbaldehyde

5-(2-cyclobutylphenyl)furan-2-carbaldehyde (PubChem CID 106886627) has the molecular formula C15H14O2 and a molecular weight of 226.28 g/mol. Its IUPAC name is 5-(2-cyclobutylphenyl)furan-2-carbaldehyde.

Molecular Properties

Compound Name5-(2-cyclobutylphenyl)furan-2-carbaldehyde
PubChem CID106886627
Molecular FormulaC15H14O2
Molecular Weight226.28 g/mol
Exact Mass226.10
IUPAC Name5-(2-cyclobutylphenyl)furan-2-carbaldehyde
SMILESO=Cc1ccc(-c2ccccc2C2CCC2)o1
InChIInChI=1S/C15H14O2/c16-10-12-8-9-15(17-12)14-7-2-1-6-13(14)11-4-3-5-11/h1-2,6-11H,3-5H2
InChIKeyCRJRBFSRVIDXHW-UHFFFAOYSA-N
XLogP4.03
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 54.03
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

1-cyclobutyl-2-phenylbenzene
CID 23453799
5-[2-(piperidine-1-carbonyl)phenyl]furan-2-carbaldehyde
CID 169334647
5-dibenzofuran-1-ylfuran-2-carbaldehyde
CID 169332087
2-[2-(2-cyclohexylphenyl)phenyl]benzene-1,3-dicarbaldehyde
CID 87274435
1-[2-(5-formylfuran-2-yl)phenyl]piperidine-4-carboxamide
CID 169335732
2-(5-formylfuran-2-yl)-N-(oxolan-2-ylmethyl)benzamide
CID 169333386
5-(5-bromonaphthalen-1-yl)furan-2-carbaldehyde
CID 169331923
5-(2-cycloheptylphenyl)-1,2-oxazole-3-carboxylic acid
CID 117459601
5-[4-(2-methoxyphenyl)phenyl]furan-2-carbaldehyde
CID 169332736
5-[2-(3,4-difluorophenyl)phenyl]furan-2-carbaldehyde
CID 169333066
2-(5-formylfuran-2-yl)-N,N-dimethylbenzamide
CID 169332033
2-cyclodecylbenzaldehyde
CID 142358507

Frequently Asked Questions

What is the IUPAC name of 5-(2-cyclobutylphenyl)furan-2-carbaldehyde?
The IUPAC name of 5-(2-cyclobutylphenyl)furan-2-carbaldehyde (CID 106886627) is 5-(2-cyclobutylphenyl)furan-2-carbaldehyde.
What is the SMILES notation for 5-(2-cyclobutylphenyl)furan-2-carbaldehyde?
The canonical SMILES for 5-(2-cyclobutylphenyl)furan-2-carbaldehyde is O=Cc1ccc(-c2ccccc2C2CCC2)o1.
What is the InChIKey of 5-(2-cyclobutylphenyl)furan-2-carbaldehyde?
The InChIKey is CRJRBFSRVIDXHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O2/c16-10-12-8-9-15(17-12)14-7-2-1-6-13(14)11-4-3-5-11/h1-2,6-11H,3-5H2.
What are the key properties of 5-(2-cyclobutylphenyl)furan-2-carbaldehyde?
5-(2-cyclobutylphenyl)furan-2-carbaldehyde has a molecular weight of 226.28 g/mol, XLogP of 4.03, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-cyclobutylphenyl)furan-2-carbaldehyde is sourced from PubChem (CID 106886627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).