1-cyclopropylcyclopentane-1-carbaldehyde

C9H14O — CID 131143275

IUPAC1-cyclopropylcyclopentane-1-carbaldehyde
SMILESO=CC1(C2CC2)CCCC1
InChIInChI=1S/C9H14O/c10-7-9(8-3-4-8)5-1-2-6-9/h7-8H,1-6H2
InChIKeyHFZOEJAWFDTGFX-UHFFFAOYSA-N
MW138.21 g/mol
LogP2.16
Rot. Bonds2

About 1-cyclopropylcyclopentane-1-carbaldehyde

1-cyclopropylcyclopentane-1-carbaldehyde (PubChem CID 131143275) has the molecular formula C9H14O and a molecular weight of 138.21 g/mol. Its IUPAC name is 1-cyclopropylcyclopentane-1-carbaldehyde.

Molecular Properties

Compound Name1-cyclopropylcyclopentane-1-carbaldehyde
PubChem CID131143275
Molecular FormulaC9H14O
Molecular Weight138.21 g/mol
Exact Mass138.10
IUPAC Name1-cyclopropylcyclopentane-1-carbaldehyde
SMILESO=CC1(C2CC2)CCCC1
InChIInChI=1S/C9H14O/c10-7-9(8-3-4-8)5-1-2-6-9/h7-8H,1-6H2
InChIKeyHFZOEJAWFDTGFX-UHFFFAOYSA-N
XLogP2.16
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 1-cyclopropylcyclopentane-1-carbaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropylcyclopentane-1-carbaldehyde?
The IUPAC name of 1-cyclopropylcyclopentane-1-carbaldehyde (CID 131143275) is 1-cyclopropylcyclopentane-1-carbaldehyde.
What is the SMILES notation for 1-cyclopropylcyclopentane-1-carbaldehyde?
The canonical SMILES for 1-cyclopropylcyclopentane-1-carbaldehyde is O=CC1(C2CC2)CCCC1.
What is the InChIKey of 1-cyclopropylcyclopentane-1-carbaldehyde?
The InChIKey is HFZOEJAWFDTGFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14O/c10-7-9(8-3-4-8)5-1-2-6-9/h7-8H,1-6H2.
What are the key properties of 1-cyclopropylcyclopentane-1-carbaldehyde?
1-cyclopropylcyclopentane-1-carbaldehyde has a molecular weight of 138.21 g/mol, XLogP of 2.16, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropylcyclopentane-1-carbaldehyde is sourced from PubChem (CID 131143275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).