1-methoxypropan-2-ylcyclopentane

C9H18O — CID 88998786

IUPAC1-methoxypropan-2-ylcyclopentane
SMILESCOCC(C)C1CCCC1
InChIInChI=1S/C9H18O/c1-8(7-10-2)9-5-3-4-6-9/h8-9H,3-7H2,1-2H3
InChIKeyZSXURMOEYZBVIK-UHFFFAOYSA-N
MW142.24 g/mol
LogP2.46
Rot. Bonds3

About 1-methoxypropan-2-ylcyclopentane

1-methoxypropan-2-ylcyclopentane (PubChem CID 88998786) has the molecular formula C9H18O and a molecular weight of 142.24 g/mol. Its IUPAC name is 1-methoxypropan-2-ylcyclopentane.

Molecular Properties

Compound Name1-methoxypropan-2-ylcyclopentane
PubChem CID88998786
Molecular FormulaC9H18O
Molecular Weight142.24 g/mol
Exact Mass142.14
IUPAC Name1-methoxypropan-2-ylcyclopentane
SMILESCOCC(C)C1CCCC1
InChIInChI=1S/C9H18O/c1-8(7-10-2)9-5-3-4-6-9/h8-9H,3-7H2,1-2H3
InChIKeyZSXURMOEYZBVIK-UHFFFAOYSA-N
XLogP2.46
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.24
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-methylperoxypropan-2-ylcyclohexane
CID 58133241
3-(1-methoxypropan-2-yl)cyclohexan-1-amine
CID 64503898
2-cyclopentylpropyl formate
CID 89150762
(1,4-dimethoxy-3-methylbutan-2-yl)cyclohexane
CID 142709814
N-[(1S)-1-cyclopentylethyl]-1-methoxypropan-2-amine
CID 81385867
1-chloro-3-(1-methoxypropan-2-yl)cyclopentane
CID 64515651
N-(1-cyclohexyl-2-methoxyethyl)propan-2-amine
CID 83686426
N-[(1S)-1-cyclopentylethyl]-1-cyclopropyl-2-methoxyethanamine
CID 81386494
1-cyclohexyl-4-methoxy-3-methylbutan-1-amine
CID 105079501
butan-2-ylcyclopentane;ethane
CID 143236269
butan-2-ylcyclohexadecane
CID 123713671
1-cyclopentylpropan-2-ylcyclopentane
CID 57131610

Frequently Asked Questions

What is the IUPAC name of 1-methoxypropan-2-ylcyclopentane?
The IUPAC name of 1-methoxypropan-2-ylcyclopentane (CID 88998786) is 1-methoxypropan-2-ylcyclopentane.
What is the SMILES notation for 1-methoxypropan-2-ylcyclopentane?
The canonical SMILES for 1-methoxypropan-2-ylcyclopentane is COCC(C)C1CCCC1.
What is the InChIKey of 1-methoxypropan-2-ylcyclopentane?
The InChIKey is ZSXURMOEYZBVIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O/c1-8(7-10-2)9-5-3-4-6-9/h8-9H,3-7H2,1-2H3.
What are the key properties of 1-methoxypropan-2-ylcyclopentane?
1-methoxypropan-2-ylcyclopentane has a molecular weight of 142.24 g/mol, XLogP of 2.46, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxypropan-2-ylcyclopentane is sourced from PubChem (CID 88998786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).