1-methoxy-3-[1-(3-propan-2-ylcyclobutyl)oxyethyl]cyclopentane

C15H28O2 — CID 154964440

IUPAC1-methoxy-3-[1-(3-propan-2-ylcyclobutyl)oxyethyl]cyclopentane
SMILESCOC1CCC(C(C)OC2CC(C(C)C)C2)C1
InChIInChI=1S/C15H28O2/c1-10(2)13-8-15(9-13)17-11(3)12-5-6-14(7-12)16-4/h10-15H,5-9H2,1-4H3
InChIKeyPJVRKZZAKJLTMH-UHFFFAOYSA-N
MW240.39 g/mol
LogP3.64
Rot. Bonds5

About 1-methoxy-3-[1-(3-propan-2-ylcyclobutyl)oxyethyl]cyclopentane

1-methoxy-3-[1-(3-propan-2-ylcyclobutyl)oxyethyl]cyclopentane (PubChem CID 154964440) has the molecular formula C15H28O2 and a molecular weight of 240.39 g/mol. Its IUPAC name is 1-methoxy-3-[1-(3-propan-2-ylcyclobutyl)oxyethyl]cyclopentane.

Molecular Properties

Compound Name1-methoxy-3-[1-(3-propan-2-ylcyclobutyl)oxyethyl]cyclopentane
PubChem CID154964440
Molecular FormulaC15H28O2
Molecular Weight240.39 g/mol
Exact Mass240.21
IUPAC Name1-methoxy-3-[1-(3-propan-2-ylcyclobutyl)oxyethyl]cyclopentane
SMILESCOC1CCC(C(C)OC2CC(C(C)C)C2)C1
InChIInChI=1S/C15H28O2/c1-10(2)13-8-15(9-13)17-11(3)12-5-6-14(7-12)16-4/h10-15H,5-9H2,1-4H3
InChIKeyPJVRKZZAKJLTMH-UHFFFAOYSA-N
XLogP3.64
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;1-methoxy-4-propan-2-ylcyclohexane
CID 178120184
1-propan-2-yl-4-propan-2-yloxycyclohexane
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2-methoxy-5-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydropentalene
CID 155006906
cis-(1S,3R)-1,3-dimethoxycyclopentane
CID 22214084
(1S)-1-butan-2-yloxy-3-propan-2-ylcyclopentane
CID 134266441
(3R,5R)-3-methoxy-5-propan-2-ylpiperidine
CID 139339698
[4-methoxy-1-(4-propan-2-ylcycloheptyl)piperidin-2-yl]methanamine
CID 115963117
2-[(4R)-2-[(2S,5S)-5-methoxy-2-methylcyclohexyl]-4-propan-2-ylcyclohexyl]acetonitrile
CID 169190692
(2S)-2-(6-methoxy-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)propane-1,1-diol
CID 118147016
propan-2-ylcyclopropane;hydroiodide
CID 162314014
N-(dicyclopropylmethyl)-3-methoxycyclopentan-1-amine
CID 103082890
1-hydroxy-3-methoxy-5-propan-2-ylpiperidine
CID 139505715

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-[1-(3-propan-2-ylcyclobutyl)oxyethyl]cyclopentane?
The IUPAC name of 1-methoxy-3-[1-(3-propan-2-ylcyclobutyl)oxyethyl]cyclopentane (CID 154964440) is 1-methoxy-3-[1-(3-propan-2-ylcyclobutyl)oxyethyl]cyclopentane.
What is the SMILES notation for 1-methoxy-3-[1-(3-propan-2-ylcyclobutyl)oxyethyl]cyclopentane?
The canonical SMILES for 1-methoxy-3-[1-(3-propan-2-ylcyclobutyl)oxyethyl]cyclopentane is COC1CCC(C(C)OC2CC(C(C)C)C2)C1.
What is the InChIKey of 1-methoxy-3-[1-(3-propan-2-ylcyclobutyl)oxyethyl]cyclopentane?
The InChIKey is PJVRKZZAKJLTMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O2/c1-10(2)13-8-15(9-13)17-11(3)12-5-6-14(7-12)16-4/h10-15H,5-9H2,1-4H3.
What are the key properties of 1-methoxy-3-[1-(3-propan-2-ylcyclobutyl)oxyethyl]cyclopentane?
1-methoxy-3-[1-(3-propan-2-ylcyclobutyl)oxyethyl]cyclopentane has a molecular weight of 240.39 g/mol, XLogP of 3.64, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-[1-(3-propan-2-ylcyclobutyl)oxyethyl]cyclopentane is sourced from PubChem (CID 154964440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).