cyclobutyl(morpholin-4-yl)methanone

C9H15NO2 — CID 531899

IUPACcyclobutyl(morpholin-4-yl)methanone
SMILESO=C(C1CCC1)N1CCOCC1
InChIInChI=1S/C9H15NO2/c11-9(8-2-1-3-8)10-4-6-12-7-5-10/h8H,1-7H2
InChIKeyPNAUTTGUBWLOMQ-UHFFFAOYSA-N
MW169.22 g/mol
LogP0.65
Rot. Bonds1

About cyclobutyl(morpholin-4-yl)methanone

cyclobutyl(morpholin-4-yl)methanone (PubChem CID 531899) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is cyclobutyl(morpholin-4-yl)methanone.

Molecular Properties

Compound Namecyclobutyl(morpholin-4-yl)methanone
PubChem CID531899
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC Namecyclobutyl(morpholin-4-yl)methanone
SMILESO=C(C1CCC1)N1CCOCC1
InChIInChI=1S/C9H15NO2/c11-9(8-2-1-3-8)10-4-6-12-7-5-10/h8H,1-7H2
InChIKeyPNAUTTGUBWLOMQ-UHFFFAOYSA-N
XLogP0.65
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 50.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclobutyl(morpholin-4-yl)methanone?
The IUPAC name of cyclobutyl(morpholin-4-yl)methanone (CID 531899) is cyclobutyl(morpholin-4-yl)methanone.
What is the SMILES notation for cyclobutyl(morpholin-4-yl)methanone?
The canonical SMILES for cyclobutyl(morpholin-4-yl)methanone is O=C(C1CCC1)N1CCOCC1.
What is the InChIKey of cyclobutyl(morpholin-4-yl)methanone?
The InChIKey is PNAUTTGUBWLOMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO2/c11-9(8-2-1-3-8)10-4-6-12-7-5-10/h8H,1-7H2.
What are the key properties of cyclobutyl(morpholin-4-yl)methanone?
cyclobutyl(morpholin-4-yl)methanone has a molecular weight of 169.22 g/mol, XLogP of 0.65, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl(morpholin-4-yl)methanone is sourced from PubChem (CID 531899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).