2-[1-(2-methylpropyl)azetidin-3-yl]-1-morpholin-4-ylethanone

C13H24N2O2 — CID 174897023

IUPAC2-[1-(2-methylpropyl)azetidin-3-yl]-1-morpholin-4-ylethanone
SMILESCC(C)CN1CC(CC(=O)N2CCOCC2)C1
InChIInChI=1S/C13H24N2O2/c1-11(2)8-14-9-12(10-14)7-13(16)15-3-5-17-6-4-15/h11-12H,3-10H2,1-2H3
InChIKeyPIGFFMSABPGXPJ-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.82
Rot. Bonds4

About 2-[1-(2-methylpropyl)azetidin-3-yl]-1-morpholin-4-ylethanone

2-[1-(2-methylpropyl)azetidin-3-yl]-1-morpholin-4-ylethanone (PubChem CID 174897023) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-[1-(2-methylpropyl)azetidin-3-yl]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[1-(2-methylpropyl)azetidin-3-yl]-1-morpholin-4-ylethanone
PubChem CID174897023
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name2-[1-(2-methylpropyl)azetidin-3-yl]-1-morpholin-4-ylethanone
SMILESCC(C)CN1CC(CC(=O)N2CCOCC2)C1
InChIInChI=1S/C13H24N2O2/c1-11(2)8-14-9-12(10-14)7-13(16)15-3-5-17-6-4-15/h11-12H,3-10H2,1-2H3
InChIKeyPIGFFMSABPGXPJ-UHFFFAOYSA-N
XLogP0.82
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-morpholin-4-yl-2-oxoethyl)azetidine-1-carboxylic acid
CID 145259546
1-morpholin-4-yl-2-(4-propan-2-ylcyclohexyl)ethanone
CID 58394969
2-[1-(2-morpholin-4-yl-2-oxoethyl)azetidin-3-yl]acetic acid
CID 64616071
[1-(2-methylpropyl)piperidin-4-yl]-morpholin-4-ylmethanone
CID 883920
2-[4-(2-methylpropyl)piperidin-1-yl]-1-morpholin-4-ylethanone
CID 145317208
formaldehyde;3-methyl-1-morpholin-4-ylbutan-1-one
CID 143869951
(2S)-2-[4-(2-cyclopentylacetyl)piperazin-1-yl]-1-morpholin-4-ylpropan-1-one
CID 95318440
1-morpholin-4-yl-2-(oxan-3-yl)ethanone
CID 110849361
2-[1-(2-morpholin-4-yl-2-oxoethyl)azetidin-3-yl]propanoic acid
CID 116684337
2-[1-[(4-methylphenyl)methyl]piperidin-4-yl]-1-morpholin-4-ylethanone
CID 175649098
3-methyl-1-[4-(morpholin-4-ylmethyl)piperidin-1-yl]butan-1-one
CID 110284682
[4-(2-methylpropyl)piperazin-1-yl]-(oxan-4-yl)methanone
CID 113072893

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-methylpropyl)azetidin-3-yl]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[1-(2-methylpropyl)azetidin-3-yl]-1-morpholin-4-ylethanone (CID 174897023) is 2-[1-(2-methylpropyl)azetidin-3-yl]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[1-(2-methylpropyl)azetidin-3-yl]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[1-(2-methylpropyl)azetidin-3-yl]-1-morpholin-4-ylethanone is CC(C)CN1CC(CC(=O)N2CCOCC2)C1.
What is the InChIKey of 2-[1-(2-methylpropyl)azetidin-3-yl]-1-morpholin-4-ylethanone?
The InChIKey is PIGFFMSABPGXPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-11(2)8-14-9-12(10-14)7-13(16)15-3-5-17-6-4-15/h11-12H,3-10H2,1-2H3.
What are the key properties of 2-[1-(2-methylpropyl)azetidin-3-yl]-1-morpholin-4-ylethanone?
2-[1-(2-methylpropyl)azetidin-3-yl]-1-morpholin-4-ylethanone has a molecular weight of 240.35 g/mol, XLogP of 0.82, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-methylpropyl)azetidin-3-yl]-1-morpholin-4-ylethanone is sourced from PubChem (CID 174897023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).