2-methyl-1-propylcyclopentane-1-carbaldehyde

C10H18O — CID 130655342

IUPAC2-methyl-1-propylcyclopentane-1-carbaldehyde
SMILESCCCC1(C=O)CCCC1C
InChIInChI=1S/C10H18O/c1-3-6-10(8-11)7-4-5-9(10)2/h8-9H,3-7H2,1-2H3
InChIKeyUQOZJAXJPOIVTL-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.79
Rot. Bonds3

About 2-methyl-1-propylcyclopentane-1-carbaldehyde

2-methyl-1-propylcyclopentane-1-carbaldehyde (PubChem CID 130655342) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 2-methyl-1-propylcyclopentane-1-carbaldehyde.

Molecular Properties

Compound Name2-methyl-1-propylcyclopentane-1-carbaldehyde
PubChem CID130655342
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name2-methyl-1-propylcyclopentane-1-carbaldehyde
SMILESCCCC1(C=O)CCCC1C
InChIInChI=1S/C10H18O/c1-3-6-10(8-11)7-4-5-9(10)2/h8-9H,3-7H2,1-2H3
InChIKeyUQOZJAXJPOIVTL-UHFFFAOYSA-N
XLogP2.79
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.79
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

trans-(1S,2S)-2-methyl-1-(2-oxopropyl)cyclohexane-1-carbaldehyde
CID 130753828
1-[(E)-3-chloroprop-2-enyl]-2-methylcyclohexane-1-carbaldehyde
CID 131237182
2-methyl-1-propoxycyclohexane-1-carbaldehyde
CID 165494983
1,2-diethylcyclohexane-1-carbaldehyde
CID 138734421
2-methyl-1-(1,2,5-thiadiazol-3-ylmethyl)cyclohexane-1-carbaldehyde
CID 130941468
1,2-diethylcyclododecane-1-carbaldehyde
CID 138734450
2-methyl-1-(2-methyl-1-propylcyclohexyl)sulfanyl-1-propylcyclohexane
CID 141375882
cis-(1R,2S)-1,2-dimethylcyclohexane-1-carbaldehyde
CID 131195965
1-ethyl-N-(1-ethyl-2-methylcyclopentyl)-2-methylcyclopentan-1-amine
CID 66643253
1-[(1S,2S)-1-(bromomethyl)-2-methylcyclohexyl]-N-ethylmethanimine
CID 163693507
1-(2-methyl-1-propoxycyclopentyl)ethanone
CID 83226617
1,2-dimethylcycloundecane-1-carbaldehyde
CID 138734446

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-propylcyclopentane-1-carbaldehyde?
The IUPAC name of 2-methyl-1-propylcyclopentane-1-carbaldehyde (CID 130655342) is 2-methyl-1-propylcyclopentane-1-carbaldehyde.
What is the SMILES notation for 2-methyl-1-propylcyclopentane-1-carbaldehyde?
The canonical SMILES for 2-methyl-1-propylcyclopentane-1-carbaldehyde is CCCC1(C=O)CCCC1C.
What is the InChIKey of 2-methyl-1-propylcyclopentane-1-carbaldehyde?
The InChIKey is UQOZJAXJPOIVTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-3-6-10(8-11)7-4-5-9(10)2/h8-9H,3-7H2,1-2H3.
What are the key properties of 2-methyl-1-propylcyclopentane-1-carbaldehyde?
2-methyl-1-propylcyclopentane-1-carbaldehyde has a molecular weight of 154.25 g/mol, XLogP of 2.79, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-propylcyclopentane-1-carbaldehyde is sourced from PubChem (CID 130655342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).