2-cyclopropyl-3-(furan-2-yl)propanal

C10H12O2 — CID 83826737

IUPAC2-cyclopropyl-3-(furan-2-yl)propanal
SMILESO=CC(Cc1ccco1)C1CC1
InChIInChI=1S/C10H12O2/c11-7-9(8-3-4-8)6-10-2-1-5-12-10/h1-2,5,7-9H,3-4,6H2
InChIKeyHGXNNVVPINRYLF-UHFFFAOYSA-N
MW164.20 g/mol
LogP2.05
Rot. Bonds4

About 2-cyclopropyl-3-(furan-2-yl)propanal

2-cyclopropyl-3-(furan-2-yl)propanal (PubChem CID 83826737) has the molecular formula C10H12O2 and a molecular weight of 164.20 g/mol. Its IUPAC name is 2-cyclopropyl-3-(furan-2-yl)propanal.

Molecular Properties

Compound Name2-cyclopropyl-3-(furan-2-yl)propanal
PubChem CID83826737
Molecular FormulaC10H12O2
Molecular Weight164.20 g/mol
Exact Mass164.08
IUPAC Name2-cyclopropyl-3-(furan-2-yl)propanal
SMILESO=CC(Cc1ccco1)C1CC1
InChIInChI=1S/C10H12O2/c11-7-9(8-3-4-8)6-10-2-1-5-12-10/h1-2,5,7-9H,3-4,6H2
InChIKeyHGXNNVVPINRYLF-UHFFFAOYSA-N
XLogP2.05
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.20
LogP ≤ 52.05
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-cyclopentyl-3-(furan-2-yl)propan-2-amine
CID 105029465
[1-(furan-2-yl)-3-(thian-4-yl)propan-2-yl]hydrazine
CID 105331670
1-cycloheptyl-2-(furan-2-yl)-N-methylethanamine
CID 83175244
2-(furan-2-yl)-1-(oxan-4-yl)ethanamine
CID 83175646
1-cycloheptyl-3-(furan-2-yl)-N-propylpropan-2-amine
CID 105029141
1-cyclopropyl-2-(furan-2-yl)ethanone
CID 83172331
2-(furan-2-yl)ethane-1,1-diol
CID 156698008
1-(4,4-difluorocyclohexyl)-2-(furan-2-yl)ethanamine
CID 105177457
2-(furan-2-yl)-1-[(3R)-pyrrolidin-3-yl]ethanol
CID 164662141
N-(1-cyclopentylethyl)-1-(furan-2-yl)propan-2-amine
CID 62634085
2-(1,1-dioxothiolan-3-yl)-3-(furan-2-yl)propan-1-amine
CID 62998485
2-cyclopropyl-4-phenylbutanal
CID 83829133

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-3-(furan-2-yl)propanal?
The IUPAC name of 2-cyclopropyl-3-(furan-2-yl)propanal (CID 83826737) is 2-cyclopropyl-3-(furan-2-yl)propanal.
What is the SMILES notation for 2-cyclopropyl-3-(furan-2-yl)propanal?
The canonical SMILES for 2-cyclopropyl-3-(furan-2-yl)propanal is O=CC(Cc1ccco1)C1CC1.
What is the InChIKey of 2-cyclopropyl-3-(furan-2-yl)propanal?
The InChIKey is HGXNNVVPINRYLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O2/c11-7-9(8-3-4-8)6-10-2-1-5-12-10/h1-2,5,7-9H,3-4,6H2.
What are the key properties of 2-cyclopropyl-3-(furan-2-yl)propanal?
2-cyclopropyl-3-(furan-2-yl)propanal has a molecular weight of 164.20 g/mol, XLogP of 2.05, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-3-(furan-2-yl)propanal is sourced from PubChem (CID 83826737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).