1-propan-2-yl-2-propan-2-yloxycyclopentane

C11H22O — CID 58822960

IUPAC1-propan-2-yl-2-propan-2-yloxycyclopentane
SMILESCC(C)OC1CCCC1C(C)C
InChIInChI=1S/C11H22O/c1-8(2)10-6-5-7-11(10)12-9(3)4/h8-11H,5-7H2,1-4H3
InChIKeyFSGCOPWJYGGEPP-UHFFFAOYSA-N
MW170.30 g/mol
LogP3.24
Rot. Bonds3

About 1-propan-2-yl-2-propan-2-yloxycyclopentane

1-propan-2-yl-2-propan-2-yloxycyclopentane (PubChem CID 58822960) has the molecular formula C11H22O and a molecular weight of 170.30 g/mol. Its IUPAC name is 1-propan-2-yl-2-propan-2-yloxycyclopentane.

Molecular Properties

Compound Name1-propan-2-yl-2-propan-2-yloxycyclopentane
PubChem CID58822960
Molecular FormulaC11H22O
Molecular Weight170.30 g/mol
Exact Mass170.17
IUPAC Name1-propan-2-yl-2-propan-2-yloxycyclopentane
SMILESCC(C)OC1CCCC1C(C)C
InChIInChI=1S/C11H22O/c1-8(2)10-6-5-7-11(10)12-9(3)4/h8-11H,5-7H2,1-4H3
InChIKeyFSGCOPWJYGGEPP-UHFFFAOYSA-N
XLogP3.24
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

rac-(1R,2S)-2-(propan-2-yl)cyclopentan-1-ol
CID 59118624
2-Isopropylcyclopentan-1-ol
CID 15593851
alpha-Isobutyltetrahydrofuran
CID 14242113
2-n-Propyl-3-methyl-tetrahydrofuran
CID 18965607
a-(2-Methylbutyl)tetrahydrofuran
CID 53654831
Tetrahydro-2,3-dimethyl-5-propylfuran
CID 59089354
4-Methyl-2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyran
CID 134859099
(2R,3S,4R,5S,6R)-2-ethyl-3,4,5,6-tetramethyloxane
CID 163662821
(2R,3R,4R,5S,6R)-2-ethyl-3,4,5,6-tetramethyloxane
CID 163662822
(2R,3S,4S,5S,6R)-2-ethyl-3,4,5,6-tetramethyloxane
CID 163662836
3-Butyltetrahydro-2-methylfuran (trans)
CID 37514
14-Methyl-13-oxabicyclo[10.3.0]pentadecane
CID 11085454

Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-2-propan-2-yloxycyclopentane?
The IUPAC name of 1-propan-2-yl-2-propan-2-yloxycyclopentane (CID 58822960) is 1-propan-2-yl-2-propan-2-yloxycyclopentane.
What is the SMILES notation for 1-propan-2-yl-2-propan-2-yloxycyclopentane?
The canonical SMILES for 1-propan-2-yl-2-propan-2-yloxycyclopentane is CC(C)OC1CCCC1C(C)C.
What is the InChIKey of 1-propan-2-yl-2-propan-2-yloxycyclopentane?
The InChIKey is FSGCOPWJYGGEPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O/c1-8(2)10-6-5-7-11(10)12-9(3)4/h8-11H,5-7H2,1-4H3.
What are the key properties of 1-propan-2-yl-2-propan-2-yloxycyclopentane?
1-propan-2-yl-2-propan-2-yloxycyclopentane has a molecular weight of 170.30 g/mol, XLogP of 3.24, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-2-propan-2-yloxycyclopentane is sourced from PubChem (CID 58822960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).