2-(1-methoxycyclobutyl)-1-morpholin-4-ylethanone

C11H19NO3 — CID 103517363

IUPAC2-(1-methoxycyclobutyl)-1-morpholin-4-ylethanone
SMILESCOC1(CC(=O)N2CCOCC2)CCC1
InChIInChI=1S/C11H19NO3/c1-14-11(3-2-4-11)9-10(13)12-5-7-15-8-6-12/h2-9H2,1H3
InChIKeyBIMYETFCBNEOOK-UHFFFAOYSA-N
MW213.28 g/mol
LogP0.80
Rot. Bonds3

About 2-(1-methoxycyclobutyl)-1-morpholin-4-ylethanone

2-(1-methoxycyclobutyl)-1-morpholin-4-ylethanone (PubChem CID 103517363) has the molecular formula C11H19NO3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 2-(1-methoxycyclobutyl)-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-(1-methoxycyclobutyl)-1-morpholin-4-ylethanone
PubChem CID103517363
Molecular FormulaC11H19NO3
Molecular Weight213.28 g/mol
Exact Mass213.14
IUPAC Name2-(1-methoxycyclobutyl)-1-morpholin-4-ylethanone
SMILESCOC1(CC(=O)N2CCOCC2)CCC1
InChIInChI=1S/C11H19NO3/c1-14-11(3-2-4-11)9-10(13)12-5-7-15-8-6-12/h2-9H2,1H3
InChIKeyBIMYETFCBNEOOK-UHFFFAOYSA-N
XLogP0.80
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 50.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxycyclobutyl)-1-morpholin-4-ylethanone?
The IUPAC name of 2-(1-methoxycyclobutyl)-1-morpholin-4-ylethanone (CID 103517363) is 2-(1-methoxycyclobutyl)-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-(1-methoxycyclobutyl)-1-morpholin-4-ylethanone?
The canonical SMILES for 2-(1-methoxycyclobutyl)-1-morpholin-4-ylethanone is COC1(CC(=O)N2CCOCC2)CCC1.
What is the InChIKey of 2-(1-methoxycyclobutyl)-1-morpholin-4-ylethanone?
The InChIKey is BIMYETFCBNEOOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3/c1-14-11(3-2-4-11)9-10(13)12-5-7-15-8-6-12/h2-9H2,1H3.
What are the key properties of 2-(1-methoxycyclobutyl)-1-morpholin-4-ylethanone?
2-(1-methoxycyclobutyl)-1-morpholin-4-ylethanone has a molecular weight of 213.28 g/mol, XLogP of 0.80, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxycyclobutyl)-1-morpholin-4-ylethanone is sourced from PubChem (CID 103517363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).