4-(2-cyclopropyl-2-oxoethyl)morpholin-3-one

C9H13NO3 — CID 79468968

IUPAC4-(2-cyclopropyl-2-oxoethyl)morpholin-3-one
SMILESO=C(CN1CCOCC1=O)C1CC1
InChIInChI=1S/C9H13NO3/c11-8(7-1-2-7)5-10-3-4-13-6-9(10)12/h7H,1-6H2
InChIKeyCPKSPAIXMBJVBM-UHFFFAOYSA-N
MW183.21 g/mol
LogP-0.18
Rot. Bonds3

About 4-(2-cyclopropyl-2-oxoethyl)morpholin-3-one

4-(2-cyclopropyl-2-oxoethyl)morpholin-3-one (PubChem CID 79468968) has the molecular formula C9H13NO3 and a molecular weight of 183.21 g/mol. Its IUPAC name is 4-(2-cyclopropyl-2-oxoethyl)morpholin-3-one.

Molecular Properties

Compound Name4-(2-cyclopropyl-2-oxoethyl)morpholin-3-one
PubChem CID79468968
Molecular FormulaC9H13NO3
Molecular Weight183.21 g/mol
Exact Mass183.09
IUPAC Name4-(2-cyclopropyl-2-oxoethyl)morpholin-3-one
SMILESO=C(CN1CCOCC1=O)C1CC1
InChIInChI=1S/C9H13NO3/c11-8(7-1-2-7)5-10-3-4-13-6-9(10)12/h7H,1-6H2
InChIKeyCPKSPAIXMBJVBM-UHFFFAOYSA-N
XLogP-0.18
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 5-0.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-aminophenyl)-N-methyl-2-(3-oxomorpholin-4-yl)acetamide
CID 79468372
molecular hydrogen;3-[[2-(3-oxomorpholin-4-yl)acetyl]amino]propanamide
CID 153346596
4-(2-cyclopentyl-2-oxoethyl)morpholine-3,5-dione
CID 104751314
1-(2-cyclohexyl-2-oxoethyl)azepan-2-one
CID 104751187
4-[2-(1-methylpyrrol-3-yl)-2-oxoethyl]morpholin-3-one
CID 79467616
ethene;4-[(E)-2-ethenylbut-2-enyl]morpholin-3-one
CID 143371911
2-acetamido-3-(3-oxomorpholin-4-yl)propanoic acid
CID 79469214
2-(3-oxomorpholin-4-yl)ethanolate
CID 142382646
4-(piperidin-4-ylmethyl)morpholin-3-one
CID 79469503
1-cyclopentyl-3-[2-(3-oxomorpholin-4-yl)ethyl]urea
CID 110748156
4-(2,2-dimethylpropyl)morpholin-3-one
CID 59172197
4-decylmorpholin-3-one
CID 154372852

Frequently Asked Questions

What is the IUPAC name of 4-(2-cyclopropyl-2-oxoethyl)morpholin-3-one?
The IUPAC name of 4-(2-cyclopropyl-2-oxoethyl)morpholin-3-one (CID 79468968) is 4-(2-cyclopropyl-2-oxoethyl)morpholin-3-one.
What is the SMILES notation for 4-(2-cyclopropyl-2-oxoethyl)morpholin-3-one?
The canonical SMILES for 4-(2-cyclopropyl-2-oxoethyl)morpholin-3-one is O=C(CN1CCOCC1=O)C1CC1.
What is the InChIKey of 4-(2-cyclopropyl-2-oxoethyl)morpholin-3-one?
The InChIKey is CPKSPAIXMBJVBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO3/c11-8(7-1-2-7)5-10-3-4-13-6-9(10)12/h7H,1-6H2.
What are the key properties of 4-(2-cyclopropyl-2-oxoethyl)morpholin-3-one?
4-(2-cyclopropyl-2-oxoethyl)morpholin-3-one has a molecular weight of 183.21 g/mol, XLogP of -0.18, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-cyclopropyl-2-oxoethyl)morpholin-3-one is sourced from PubChem (CID 79468968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).