4-cyclopropylcyclohexane-1-carbaldehyde

C10H16O — CID 149055202

IUPAC4-cyclopropylcyclohexane-1-carbaldehyde
SMILESO=CC1CCC(C2CC2)CC1
InChIInChI=1S/C10H16O/c11-7-8-1-3-9(4-2-8)10-5-6-10/h7-10H,1-6H2
InChIKeyQKPGEFXWSPBBEX-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.40
Rot. Bonds2

About 4-cyclopropylcyclohexane-1-carbaldehyde

4-cyclopropylcyclohexane-1-carbaldehyde (PubChem CID 149055202) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 4-cyclopropylcyclohexane-1-carbaldehyde.

Molecular Properties

Compound Name4-cyclopropylcyclohexane-1-carbaldehyde
PubChem CID149055202
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name4-cyclopropylcyclohexane-1-carbaldehyde
SMILESO=CC1CCC(C2CC2)CC1
InChIInChI=1S/C10H16O/c11-7-8-1-3-9(4-2-8)10-5-6-10/h7-10H,1-6H2
InChIKeyQKPGEFXWSPBBEX-UHFFFAOYSA-N
XLogP2.40
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropylcyclohexane-1-carbaldehyde?
The IUPAC name of 4-cyclopropylcyclohexane-1-carbaldehyde (CID 149055202) is 4-cyclopropylcyclohexane-1-carbaldehyde.
What is the SMILES notation for 4-cyclopropylcyclohexane-1-carbaldehyde?
The canonical SMILES for 4-cyclopropylcyclohexane-1-carbaldehyde is O=CC1CCC(C2CC2)CC1.
What is the InChIKey of 4-cyclopropylcyclohexane-1-carbaldehyde?
The InChIKey is QKPGEFXWSPBBEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c11-7-8-1-3-9(4-2-8)10-5-6-10/h7-10H,1-6H2.
What are the key properties of 4-cyclopropylcyclohexane-1-carbaldehyde?
4-cyclopropylcyclohexane-1-carbaldehyde has a molecular weight of 152.24 g/mol, XLogP of 2.40, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropylcyclohexane-1-carbaldehyde is sourced from PubChem (CID 149055202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).