ethane;2-[(2R)-2-methylcyclopentyl]acetaldehyde

C10H20O — CID 143647546

IUPACethane;2-[(2R)-2-methylcyclopentyl]acetaldehyde
SMILESCC.C[C@@H]1CCCC1CC=O
InChIInChI=1S/C8H14O.C2H6/c1-7-3-2-4-8(7)5-6-9;1-2/h6-8H,2-5H2,1H3;1-2H3/t7-,8?;/m1./s1
InChIKeyZQVOHRVCARLCBB-PGMKYVDRSA-N
MW156.27 g/mol
LogP3.04
Rot. Bonds2

About ethane;2-[(2R)-2-methylcyclopentyl]acetaldehyde

ethane;2-[(2R)-2-methylcyclopentyl]acetaldehyde (PubChem CID 143647546) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is ethane;2-[(2R)-2-methylcyclopentyl]acetaldehyde.

Molecular Properties

Compound Nameethane;2-[(2R)-2-methylcyclopentyl]acetaldehyde
PubChem CID143647546
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Nameethane;2-[(2R)-2-methylcyclopentyl]acetaldehyde
SMILESCC.C[C@@H]1CCCC1CC=O
InChIInChI=1S/C8H14O.C2H6/c1-7-3-2-4-8(7)5-6-9;1-2/h6-8H,2-5H2,1H3;1-2H3/t7-,8?;/m1./s1
InChIKeyZQVOHRVCARLCBB-PGMKYVDRSA-N
XLogP3.04
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 53.04
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-[(E)-but-2-enyl]-2-methylcyclohexane;ethane
CID 143661661
1-methyl-2-prop-2-enylcyclohexane
CID 15643404
1-methyl-2-[(2-methylcyclopentyl)methyl]cyclopentane
CID 148598305
1-methyl-2-penta-2,4-dienylcyclopentane
CID 162303686
1-(chloromethyl)-2-methylcyclopentane
CID 13459403
(5R)-2-methyl-5-(2-oxoethyl)cyclopentane-1-carbaldehyde
CID 130738658
ethane;trans-(1S,2R)-1-ethyl-2-methylcyclohexane
CID 143479638
1-(iodomethyl)-2-methylcyclopentane
CID 13296846
cis-(1S,2S)-1-(bromomethyl)-2-methylcyclohexane
CID 124509523
(2S)-2-methyl-3-[(1S,2S)-2-methylcyclohexyl]propanal
CID 89224154
carbanide;cyclopentane;ethane;1-ethyl-2-methylcyclopentane;iron(2+)
CID 162283607
ethane;trans-(1R,2R)-1,2-dimethylcyclopentane
CID 91129712

Frequently Asked Questions

What is the IUPAC name of ethane;2-[(2R)-2-methylcyclopentyl]acetaldehyde?
The IUPAC name of ethane;2-[(2R)-2-methylcyclopentyl]acetaldehyde (CID 143647546) is ethane;2-[(2R)-2-methylcyclopentyl]acetaldehyde.
What is the SMILES notation for ethane;2-[(2R)-2-methylcyclopentyl]acetaldehyde?
The canonical SMILES for ethane;2-[(2R)-2-methylcyclopentyl]acetaldehyde is CC.C[C@@H]1CCCC1CC=O.
What is the InChIKey of ethane;2-[(2R)-2-methylcyclopentyl]acetaldehyde?
The InChIKey is ZQVOHRVCARLCBB-PGMKYVDRSA-N. The full InChI is InChI=1S/C8H14O.C2H6/c1-7-3-2-4-8(7)5-6-9;1-2/h6-8H,2-5H2,1H3;1-2H3/t7-,8?;/m1./s1.
What are the key properties of ethane;2-[(2R)-2-methylcyclopentyl]acetaldehyde?
ethane;2-[(2R)-2-methylcyclopentyl]acetaldehyde has a molecular weight of 156.27 g/mol, XLogP of 3.04, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-[(2R)-2-methylcyclopentyl]acetaldehyde is sourced from PubChem (CID 143647546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).