1-methoxy-2-propan-2-ylcyclopropane

C7H14O — CID 77441779

IUPAC1-methoxy-2-propan-2-ylcyclopropane
SMILESCOC1CC1C(C)C
InChIInChI=1S/C7H14O/c1-5(2)6-4-7(6)8-3/h5-7H,4H2,1-3H3
InChIKeyMNFWMCTVCYSEJR-UHFFFAOYSA-N
MW114.19 g/mol
LogP1.68
Rot. Bonds2

About 1-methoxy-2-propan-2-ylcyclopropane

1-methoxy-2-propan-2-ylcyclopropane (PubChem CID 77441779) has the molecular formula C7H14O and a molecular weight of 114.19 g/mol. Its IUPAC name is 1-methoxy-2-propan-2-ylcyclopropane.

Molecular Properties

Compound Name1-methoxy-2-propan-2-ylcyclopropane
PubChem CID77441779
Molecular FormulaC7H14O
Molecular Weight114.19 g/mol
Exact Mass114.10
IUPAC Name1-methoxy-2-propan-2-ylcyclopropane
SMILESCOC1CC1C(C)C
InChIInChI=1S/C7H14O/c1-5(2)6-4-7(6)8-3/h5-7H,4H2,1-3H3
InChIKeyMNFWMCTVCYSEJR-UHFFFAOYSA-N
XLogP1.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.19
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-propan-2-ylcyclopropane?
The IUPAC name of 1-methoxy-2-propan-2-ylcyclopropane (CID 77441779) is 1-methoxy-2-propan-2-ylcyclopropane.
What is the SMILES notation for 1-methoxy-2-propan-2-ylcyclopropane?
The canonical SMILES for 1-methoxy-2-propan-2-ylcyclopropane is COC1CC1C(C)C.
What is the InChIKey of 1-methoxy-2-propan-2-ylcyclopropane?
The InChIKey is MNFWMCTVCYSEJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O/c1-5(2)6-4-7(6)8-3/h5-7H,4H2,1-3H3.
What are the key properties of 1-methoxy-2-propan-2-ylcyclopropane?
1-methoxy-2-propan-2-ylcyclopropane has a molecular weight of 114.19 g/mol, XLogP of 1.68, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-propan-2-ylcyclopropane is sourced from PubChem (CID 77441779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).