1-ethoxy-3-(1-methoxycyclobutyl)propan-2-ol

C10H20O3 — CID 103560182

IUPAC1-ethoxy-3-(1-methoxycyclobutyl)propan-2-ol
SMILESCCOCC(O)CC1(OC)CCC1
InChIInChI=1S/C10H20O3/c1-3-13-8-9(11)7-10(12-2)5-4-6-10/h9,11H,3-8H2,1-2H3
InChIKeyHENAVIXAACIWBJ-UHFFFAOYSA-N
MW188.27 g/mol
LogP1.34
Rot. Bonds6

About 1-ethoxy-3-(1-methoxycyclobutyl)propan-2-ol

1-ethoxy-3-(1-methoxycyclobutyl)propan-2-ol (PubChem CID 103560182) has the molecular formula C10H20O3 and a molecular weight of 188.27 g/mol. Its IUPAC name is 1-ethoxy-3-(1-methoxycyclobutyl)propan-2-ol.

Molecular Properties

Compound Name1-ethoxy-3-(1-methoxycyclobutyl)propan-2-ol
PubChem CID103560182
Molecular FormulaC10H20O3
Molecular Weight188.27 g/mol
Exact Mass188.14
IUPAC Name1-ethoxy-3-(1-methoxycyclobutyl)propan-2-ol
SMILESCCOCC(O)CC1(OC)CCC1
InChIInChI=1S/C10H20O3/c1-3-13-8-9(11)7-10(12-2)5-4-6-10/h9,11H,3-8H2,1-2H3
InChIKeyHENAVIXAACIWBJ-UHFFFAOYSA-N
XLogP1.34
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-3-(1-methoxycyclobutyl)propan-2-ol?
The IUPAC name of 1-ethoxy-3-(1-methoxycyclobutyl)propan-2-ol (CID 103560182) is 1-ethoxy-3-(1-methoxycyclobutyl)propan-2-ol.
What is the SMILES notation for 1-ethoxy-3-(1-methoxycyclobutyl)propan-2-ol?
The canonical SMILES for 1-ethoxy-3-(1-methoxycyclobutyl)propan-2-ol is CCOCC(O)CC1(OC)CCC1.
What is the InChIKey of 1-ethoxy-3-(1-methoxycyclobutyl)propan-2-ol?
The InChIKey is HENAVIXAACIWBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O3/c1-3-13-8-9(11)7-10(12-2)5-4-6-10/h9,11H,3-8H2,1-2H3.
What are the key properties of 1-ethoxy-3-(1-methoxycyclobutyl)propan-2-ol?
1-ethoxy-3-(1-methoxycyclobutyl)propan-2-ol has a molecular weight of 188.27 g/mol, XLogP of 1.34, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-3-(1-methoxycyclobutyl)propan-2-ol is sourced from PubChem (CID 103560182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).