1,2,5-trimethyl-1-propan-2-yloxycyclopentane

C11H22O — CID 59115599

IUPAC1,2,5-trimethyl-1-propan-2-yloxycyclopentane
SMILESCC(C)OC1(C)C(C)CCC1C
InChIInChI=1S/C11H22O/c1-8(2)12-11(5)9(3)6-7-10(11)4/h8-10H,6-7H2,1-5H3
InChIKeyDMXJVFRAONPYQU-UHFFFAOYSA-N
MW170.30 g/mol
LogP3.24
Rot. Bonds2

About 1,2,5-trimethyl-1-propan-2-yloxycyclopentane

1,2,5-trimethyl-1-propan-2-yloxycyclopentane (PubChem CID 59115599) has the molecular formula C11H22O and a molecular weight of 170.30 g/mol. Its IUPAC name is 1,2,5-trimethyl-1-propan-2-yloxycyclopentane.

Molecular Properties

Compound Name1,2,5-trimethyl-1-propan-2-yloxycyclopentane
PubChem CID59115599
Molecular FormulaC11H22O
Molecular Weight170.30 g/mol
Exact Mass170.17
IUPAC Name1,2,5-trimethyl-1-propan-2-yloxycyclopentane
SMILESCC(C)OC1(C)C(C)CCC1C
InChIInChI=1S/C11H22O/c1-8(2)12-11(5)9(3)6-7-10(11)4/h8-10H,6-7H2,1-5H3
InChIKeyDMXJVFRAONPYQU-UHFFFAOYSA-N
XLogP3.24
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
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

1,2-Dimethylcyclopentyl methyl ether
CID 59886932
trans-(1S,2S)-1-methyl-2-[(2-methylpropan-2-yl)oxy]cyclopentane
CID 102209276
cis-(1R,2S)-1-methyl-2-[(2-methylpropan-2-yl)oxy]cyclopentane
CID 102209277
1,2-Dimethyl-4-propan-2-yloxycyclopentane
CID 20082151
1,2-Dimethyl-3-propan-2-yloxycyclopentane
CID 20782633
1,4-Dimethyl-2-propan-2-yloxycyclopentane
CID 20782634
1-Methyl-2-propan-2-yloxycyclopentane
CID 20782636
1,3-Dimethyl-2-propan-2-yloxycyclopentane
CID 20782658
5-Ethyl-2,2,3,4-tetramethyloxolane
CID 54230709
2-Methoxy-1,3-dimethylcyclopentane
CID 54480029
1-Methoxy-2-propan-2-ylcyclopentane
CID 58689233
1-Propan-2-yl-2-propan-2-yloxycyclopentane
CID 58822960

Frequently Asked Questions

What is the IUPAC name of 1,2,5-trimethyl-1-propan-2-yloxycyclopentane?
The IUPAC name of 1,2,5-trimethyl-1-propan-2-yloxycyclopentane (CID 59115599) is 1,2,5-trimethyl-1-propan-2-yloxycyclopentane.
What is the SMILES notation for 1,2,5-trimethyl-1-propan-2-yloxycyclopentane?
The canonical SMILES for 1,2,5-trimethyl-1-propan-2-yloxycyclopentane is CC(C)OC1(C)C(C)CCC1C.
What is the InChIKey of 1,2,5-trimethyl-1-propan-2-yloxycyclopentane?
The InChIKey is DMXJVFRAONPYQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O/c1-8(2)12-11(5)9(3)6-7-10(11)4/h8-10H,6-7H2,1-5H3.
What are the key properties of 1,2,5-trimethyl-1-propan-2-yloxycyclopentane?
1,2,5-trimethyl-1-propan-2-yloxycyclopentane has a molecular weight of 170.30 g/mol, XLogP of 3.24, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,5-trimethyl-1-propan-2-yloxycyclopentane is sourced from PubChem (CID 59115599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).