1-cyclopropyl-3-methylcyclopentane-1-carbaldehyde

C10H16O — CID 130680477

IUPAC1-cyclopropyl-3-methylcyclopentane-1-carbaldehyde
SMILESCC1CCC(C=O)(C2CC2)C1
InChIInChI=1S/C10H16O/c1-8-4-5-10(6-8,7-11)9-2-3-9/h7-9H,2-6H2,1H3
InChIKeyHPEIQXSXLRYWCA-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.40
Rot. Bonds2

About 1-cyclopropyl-3-methylcyclopentane-1-carbaldehyde

1-cyclopropyl-3-methylcyclopentane-1-carbaldehyde (PubChem CID 130680477) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 1-cyclopropyl-3-methylcyclopentane-1-carbaldehyde.

Molecular Properties

Compound Name1-cyclopropyl-3-methylcyclopentane-1-carbaldehyde
PubChem CID130680477
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name1-cyclopropyl-3-methylcyclopentane-1-carbaldehyde
SMILESCC1CCC(C=O)(C2CC2)C1
InChIInChI=1S/C10H16O/c1-8-4-5-10(6-8,7-11)9-2-3-9/h7-9H,2-6H2,1H3
InChIKeyHPEIQXSXLRYWCA-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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Related Compounds

1-cyclobutyl-4-methylcyclohexane-1-carbaldehyde
CID 131027775
1-(4-methylcyclohexyl)cyclobutane-1-carbaldehyde
CID 130700511
bicyclo[2.2.0]hexane-1-carbaldehyde
CID 534324
4-tert-butyl-1-cyclopropylcyclohexane-1-carbaldehyde
CID 130647229
1-cyclopropylcyclopentane-1-carbaldehyde
CID 131143275
1-cyclohexylcyclohexane-1-carbaldehyde
CID 21479214
1-(2-hydroxyethyl)-3-methylcyclopentane-1-carbaldehyde
CID 131143277
(3R,8R)-3,8-dimethylspiro[4.4]nonane
CID 171400850
1-but-2-ynyl-3-methylcyclopentane-1-carbaldehyde
CID 130672813
2,7-dimethylspiro[3.4]octane
CID 142902956
3,8-dimethylspiro[4.4]nonane;ethane
CID 178108265
1,2,6-trimethylspiro[2.4]heptane
CID 123183171

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-methylcyclopentane-1-carbaldehyde?
The IUPAC name of 1-cyclopropyl-3-methylcyclopentane-1-carbaldehyde (CID 130680477) is 1-cyclopropyl-3-methylcyclopentane-1-carbaldehyde.
What is the SMILES notation for 1-cyclopropyl-3-methylcyclopentane-1-carbaldehyde?
The canonical SMILES for 1-cyclopropyl-3-methylcyclopentane-1-carbaldehyde is CC1CCC(C=O)(C2CC2)C1.
What is the InChIKey of 1-cyclopropyl-3-methylcyclopentane-1-carbaldehyde?
The InChIKey is HPEIQXSXLRYWCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c1-8-4-5-10(6-8,7-11)9-2-3-9/h7-9H,2-6H2,1H3.
What are the key properties of 1-cyclopropyl-3-methylcyclopentane-1-carbaldehyde?
1-cyclopropyl-3-methylcyclopentane-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 1-cyclopropyl-3-methylcyclopentane-1-carbaldehyde is sourced from PubChem (CID 130680477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).