1-ethyl-1-(2-methoxyethyl)-2-methylcyclopropane

C9H18O — CID 164557776

IUPAC1-ethyl-1-(2-methoxyethyl)-2-methylcyclopropane
SMILESCCC1(CCOC)CC1C
InChIInChI=1S/C9H18O/c1-4-9(5-6-10-3)7-8(9)2/h8H,4-7H2,1-3H3
InChIKeyNBALXFCJFXCQOP-UHFFFAOYSA-N
MW142.24 g/mol
LogP2.46
Rot. Bonds4

About 1-ethyl-1-(2-methoxyethyl)-2-methylcyclopropane

1-ethyl-1-(2-methoxyethyl)-2-methylcyclopropane (PubChem CID 164557776) has the molecular formula C9H18O and a molecular weight of 142.24 g/mol. Its IUPAC name is 1-ethyl-1-(2-methoxyethyl)-2-methylcyclopropane.

Molecular Properties

Compound Name1-ethyl-1-(2-methoxyethyl)-2-methylcyclopropane
PubChem CID164557776
Molecular FormulaC9H18O
Molecular Weight142.24 g/mol
Exact Mass142.14
IUPAC Name1-ethyl-1-(2-methoxyethyl)-2-methylcyclopropane
SMILESCCC1(CCOC)CC1C
InChIInChI=1S/C9H18O/c1-4-9(5-6-10-3)7-8(9)2/h8H,4-7H2,1-3H3
InChIKeyNBALXFCJFXCQOP-UHFFFAOYSA-N
XLogP2.46
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.24
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-1-(2-methoxyethyl)-2-methylcyclopropane?
The IUPAC name of 1-ethyl-1-(2-methoxyethyl)-2-methylcyclopropane (CID 164557776) is 1-ethyl-1-(2-methoxyethyl)-2-methylcyclopropane.
What is the SMILES notation for 1-ethyl-1-(2-methoxyethyl)-2-methylcyclopropane?
The canonical SMILES for 1-ethyl-1-(2-methoxyethyl)-2-methylcyclopropane is CCC1(CCOC)CC1C.
What is the InChIKey of 1-ethyl-1-(2-methoxyethyl)-2-methylcyclopropane?
The InChIKey is NBALXFCJFXCQOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O/c1-4-9(5-6-10-3)7-8(9)2/h8H,4-7H2,1-3H3.
What are the key properties of 1-ethyl-1-(2-methoxyethyl)-2-methylcyclopropane?
1-ethyl-1-(2-methoxyethyl)-2-methylcyclopropane has a molecular weight of 142.24 g/mol, XLogP of 2.46, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-1-(2-methoxyethyl)-2-methylcyclopropane is sourced from PubChem (CID 164557776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).