cyclobutanamine;2-methoxyethanol

C7H17NO2 — CID 156885948

IUPACcyclobutanamine;2-methoxyethanol
SMILESCOCCO.NC1CCC1
InChIInChI=1S/C4H9N.C3H8O2/c5-4-2-1-3-4;1-5-3-2-4/h4H,1-3,5H2;4H,2-3H2,1H3
InChIKeyAQQBRTUJNPMIKI-UHFFFAOYSA-N
MW147.22 g/mol
LogP0.12
Rot. Bonds2

About cyclobutanamine;2-methoxyethanol

cyclobutanamine;2-methoxyethanol (PubChem CID 156885948) has the molecular formula C7H17NO2 and a molecular weight of 147.22 g/mol. Its IUPAC name is cyclobutanamine;2-methoxyethanol.

Molecular Properties

Compound Namecyclobutanamine;2-methoxyethanol
PubChem CID156885948
Molecular FormulaC7H17NO2
Molecular Weight147.22 g/mol
Exact Mass147.13
IUPAC Namecyclobutanamine;2-methoxyethanol
SMILESCOCCO.NC1CCC1
InChIInChI=1S/C4H9N.C3H8O2/c5-4-2-1-3-4;1-5-3-2-4/h4H,1-3,5H2;4H,2-3H2,1H3
InChIKeyAQQBRTUJNPMIKI-UHFFFAOYSA-N
XLogP0.12
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of cyclobutanamine;2-methoxyethanol?
The IUPAC name of cyclobutanamine;2-methoxyethanol (CID 156885948) is cyclobutanamine;2-methoxyethanol.
What is the SMILES notation for cyclobutanamine;2-methoxyethanol?
The canonical SMILES for cyclobutanamine;2-methoxyethanol is COCCO.NC1CCC1.
What is the InChIKey of cyclobutanamine;2-methoxyethanol?
The InChIKey is AQQBRTUJNPMIKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9N.C3H8O2/c5-4-2-1-3-4;1-5-3-2-4/h4H,1-3,5H2;4H,2-3H2,1H3.
What are the key properties of cyclobutanamine;2-methoxyethanol?
cyclobutanamine;2-methoxyethanol has a molecular weight of 147.22 g/mol, XLogP of 0.12, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutanamine;2-methoxyethanol is sourced from PubChem (CID 156885948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).