2-methoxypropan-2-ylcyclopentane

C9H18O — CID 58385677

IUPAC2-methoxypropan-2-ylcyclopentane
SMILESCOC(C)(C)C1CCCC1
InChIInChI=1S/C9H18O/c1-9(2,10-3)8-6-4-5-7-8/h8H,4-7H2,1-3H3
InChIKeyCWKXDMQMRFZIBA-UHFFFAOYSA-N
MW142.24 g/mol
LogP2.60
Rot. Bonds2

About 2-methoxypropan-2-ylcyclopentane

2-methoxypropan-2-ylcyclopentane (PubChem CID 58385677) has the molecular formula C9H18O and a molecular weight of 142.24 g/mol. Its IUPAC name is 2-methoxypropan-2-ylcyclopentane.

Molecular Properties

Compound Name2-methoxypropan-2-ylcyclopentane
PubChem CID58385677
Molecular FormulaC9H18O
Molecular Weight142.24 g/mol
Exact Mass142.14
IUPAC Name2-methoxypropan-2-ylcyclopentane
SMILESCOC(C)(C)C1CCCC1
InChIInChI=1S/C9H18O/c1-9(2,10-3)8-6-4-5-7-8/h8H,4-7H2,1-3H3
InChIKeyCWKXDMQMRFZIBA-UHFFFAOYSA-N
XLogP2.60
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.24
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-methoxypropan-2-ylcyclopentane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methoxypropan-2-ylcyclopentane?
The IUPAC name of 2-methoxypropan-2-ylcyclopentane (CID 58385677) is 2-methoxypropan-2-ylcyclopentane.
What is the SMILES notation for 2-methoxypropan-2-ylcyclopentane?
The canonical SMILES for 2-methoxypropan-2-ylcyclopentane is COC(C)(C)C1CCCC1.
What is the InChIKey of 2-methoxypropan-2-ylcyclopentane?
The InChIKey is CWKXDMQMRFZIBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O/c1-9(2,10-3)8-6-4-5-7-8/h8H,4-7H2,1-3H3.
What are the key properties of 2-methoxypropan-2-ylcyclopentane?
2-methoxypropan-2-ylcyclopentane has a molecular weight of 142.24 g/mol, XLogP of 2.60, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxypropan-2-ylcyclopentane is sourced from PubChem (CID 58385677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).