1-methoxy-2,3,4-trimethylcyclopentane

C9H18O — CID 59498834

IUPAC1-methoxy-2,3,4-trimethylcyclopentane
SMILESCOC1CC(C)C(C)C1C
InChIInChI=1S/C9H18O/c1-6-5-9(10-4)8(3)7(6)2/h6-9H,5H2,1-4H3
InChIKeyWJEOKCYIDDEIGR-UHFFFAOYSA-N
MW142.24 g/mol
LogP2.31
Rot. Bonds1

About 1-methoxy-2,3,4-trimethylcyclopentane

1-methoxy-2,3,4-trimethylcyclopentane (PubChem CID 59498834) has the molecular formula C9H18O and a molecular weight of 142.24 g/mol. Its IUPAC name is 1-methoxy-2,3,4-trimethylcyclopentane.

Molecular Properties

Compound Name1-methoxy-2,3,4-trimethylcyclopentane
PubChem CID59498834
Molecular FormulaC9H18O
Molecular Weight142.24 g/mol
Exact Mass142.14
IUPAC Name1-methoxy-2,3,4-trimethylcyclopentane
SMILESCOC1CC(C)C(C)C1C
InChIInChI=1S/C9H18O/c1-6-5-9(10-4)8(3)7(6)2/h6-9H,5H2,1-4H3
InChIKeyWJEOKCYIDDEIGR-UHFFFAOYSA-N
XLogP2.31
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.24
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,2-Dimethylcyclopentyl methyl ether
CID 59886932
1,2-Dimethyl-4-propan-2-yloxycyclopentane
CID 20082151
1-Ethyl-3-methoxycyclopentane
CID 20600619
1,4-Diethyl-2-methoxycyclopentane
CID 20743798
1-Ethyl-3-propan-2-yloxycyclopentane
CID 20782628
1,2-Dimethyl-3-propan-2-yloxycyclopentane
CID 20782633
1,4-Dimethyl-2-propan-2-yloxycyclopentane
CID 20782634
1,3-Dimethyl-2-propan-2-yloxycyclopentane
CID 20782658
1-Methoxy-2,3-di(propan-2-yl)cyclopentane
CID 22965804
1-Ethoxy-3-propan-2-ylcyclopentane
CID 23568581
2,3,4-Trimethylcyclopentanol
CID 53675614
(2,3,4-Trimethylcyclopentyl) formate
CID 54219645

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2,3,4-trimethylcyclopentane?
The IUPAC name of 1-methoxy-2,3,4-trimethylcyclopentane (CID 59498834) is 1-methoxy-2,3,4-trimethylcyclopentane.
What is the SMILES notation for 1-methoxy-2,3,4-trimethylcyclopentane?
The canonical SMILES for 1-methoxy-2,3,4-trimethylcyclopentane is COC1CC(C)C(C)C1C.
What is the InChIKey of 1-methoxy-2,3,4-trimethylcyclopentane?
The InChIKey is WJEOKCYIDDEIGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O/c1-6-5-9(10-4)8(3)7(6)2/h6-9H,5H2,1-4H3.
What are the key properties of 1-methoxy-2,3,4-trimethylcyclopentane?
1-methoxy-2,3,4-trimethylcyclopentane has a molecular weight of 142.24 g/mol, XLogP of 2.31, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2,3,4-trimethylcyclopentane is sourced from PubChem (CID 59498834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).