1-butyl-2-ethylcyclopropane;1-methoxypropane

C13H28O — CID 143686093

IUPAC1-butyl-2-ethylcyclopropane;1-methoxypropane
SMILESCCCCC1CC1CC.CCCOC
InChIInChI=1S/C9H18.C4H10O/c1-3-5-6-9-7-8(9)4-2;1-3-4-5-2/h8-9H,3-7H2,1-2H3;3-4H2,1-2H3
InChIKeyYILQKIOKLOKNDJ-UHFFFAOYSA-N
MW200.37 g/mol
LogP4.27
Rot. Bonds6

About 1-butyl-2-ethylcyclopropane;1-methoxypropane

1-butyl-2-ethylcyclopropane;1-methoxypropane (PubChem CID 143686093) has the molecular formula C13H28O and a molecular weight of 200.37 g/mol. Its IUPAC name is 1-butyl-2-ethylcyclopropane;1-methoxypropane.

Molecular Properties

Compound Name1-butyl-2-ethylcyclopropane;1-methoxypropane
PubChem CID143686093
Molecular FormulaC13H28O
Molecular Weight200.37 g/mol
Exact Mass200.21
IUPAC Name1-butyl-2-ethylcyclopropane;1-methoxypropane
SMILESCCCCC1CC1CC.CCCOC
InChIInChI=1S/C9H18.C4H10O/c1-3-5-6-9-7-8(9)4-2;1-3-4-5-2/h8-9H,3-7H2,1-2H3;3-4H2,1-2H3
InChIKeyYILQKIOKLOKNDJ-UHFFFAOYSA-N
XLogP4.27
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.37
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-butyl-2-ethylcyclopropane;1-methoxypropane?
The IUPAC name of 1-butyl-2-ethylcyclopropane;1-methoxypropane (CID 143686093) is 1-butyl-2-ethylcyclopropane;1-methoxypropane.
What is the SMILES notation for 1-butyl-2-ethylcyclopropane;1-methoxypropane?
The canonical SMILES for 1-butyl-2-ethylcyclopropane;1-methoxypropane is CCCCC1CC1CC.CCCOC.
What is the InChIKey of 1-butyl-2-ethylcyclopropane;1-methoxypropane?
The InChIKey is YILQKIOKLOKNDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18.C4H10O/c1-3-5-6-9-7-8(9)4-2;1-3-4-5-2/h8-9H,3-7H2,1-2H3;3-4H2,1-2H3.
What are the key properties of 1-butyl-2-ethylcyclopropane;1-methoxypropane?
1-butyl-2-ethylcyclopropane;1-methoxypropane has a molecular weight of 200.37 g/mol, XLogP of 4.27, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-2-ethylcyclopropane;1-methoxypropane is sourced from PubChem (CID 143686093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).