3-(4-cyclopropyl-5-oxomorpholin-3-yl)propanoic acid

C10H15NO4 — CID 115060435

IUPAC3-(4-cyclopropyl-5-oxomorpholin-3-yl)propanoic acid
SMILESO=C(O)CCC1COCC(=O)N1C1CC1
InChIInChI=1S/C10H15NO4/c12-9-6-15-5-8(3-4-10(13)14)11(9)7-1-2-7/h7-8H,1-6H2,(H,13,14)
InChIKeyFNFSGGHTEVZHJW-UHFFFAOYSA-N
MW213.23 g/mol
LogP0.24
Rot. Bonds4

About 3-(4-cyclopropyl-5-oxomorpholin-3-yl)propanoic acid

3-(4-cyclopropyl-5-oxomorpholin-3-yl)propanoic acid (PubChem CID 115060435) has the molecular formula C10H15NO4 and a molecular weight of 213.23 g/mol. Its IUPAC name is 3-(4-cyclopropyl-5-oxomorpholin-3-yl)propanoic acid.

Molecular Properties

Compound Name3-(4-cyclopropyl-5-oxomorpholin-3-yl)propanoic acid
PubChem CID115060435
Molecular FormulaC10H15NO4
Molecular Weight213.23 g/mol
Exact Mass213.10
IUPAC Name3-(4-cyclopropyl-5-oxomorpholin-3-yl)propanoic acid
SMILESO=C(O)CCC1COCC(=O)N1C1CC1
InChIInChI=1S/C10H15NO4/c12-9-6-15-5-8(3-4-10(13)14)11(9)7-1-2-7/h7-8H,1-6H2,(H,13,14)
InChIKeyFNFSGGHTEVZHJW-UHFFFAOYSA-N
XLogP0.24
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.23
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-tert-butyl-5-oxomorpholin-3-yl)propanoic acid
CID 115060537
3-(5-oxo-4-propylmorpholin-3-yl)propanoic acid
CID 115060552
5-(3-aminopropyl)-4-cyclopentylmorpholin-3-one
CID 115060442
5-(hydroxymethyl)-4-(thian-4-yl)morpholin-3-one
CID 115102593
3-[4-(2-hydroxyphenyl)-5-oxomorpholin-3-yl]propanoic acid
CID 115060501
3-[5-oxo-4-(pyridin-4-ylmethyl)morpholin-3-yl]propanoic acid
CID 117009713
3-[4-[(2-methylphenyl)methyl]-5-oxomorpholin-3-yl]propanoic acid
CID 115060609
3-[4-[(2-chlorophenyl)methyl]-5-oxomorpholin-3-yl]propanoic acid
CID 115060611
2-(1-cyclopropyl-4-oxoazetidin-2-yl)acetic acid
CID 115013531
3-(3-cyclohexyl-2-oxo-1,3-oxazinan-4-yl)propanoic acid
CID 117011303
5-(aminomethyl)-4-(1-methylpyrrolidin-3-yl)morpholin-3-one
CID 115102568
4-(1-ethylpyrrolidin-3-yl)-5-(hydroxymethyl)morpholin-3-one
CID 115102576

Frequently Asked Questions

What is the IUPAC name of 3-(4-cyclopropyl-5-oxomorpholin-3-yl)propanoic acid?
The IUPAC name of 3-(4-cyclopropyl-5-oxomorpholin-3-yl)propanoic acid (CID 115060435) is 3-(4-cyclopropyl-5-oxomorpholin-3-yl)propanoic acid.
What is the SMILES notation for 3-(4-cyclopropyl-5-oxomorpholin-3-yl)propanoic acid?
The canonical SMILES for 3-(4-cyclopropyl-5-oxomorpholin-3-yl)propanoic acid is O=C(O)CCC1COCC(=O)N1C1CC1.
What is the InChIKey of 3-(4-cyclopropyl-5-oxomorpholin-3-yl)propanoic acid?
The InChIKey is FNFSGGHTEVZHJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO4/c12-9-6-15-5-8(3-4-10(13)14)11(9)7-1-2-7/h7-8H,1-6H2,(H,13,14).
What are the key properties of 3-(4-cyclopropyl-5-oxomorpholin-3-yl)propanoic acid?
3-(4-cyclopropyl-5-oxomorpholin-3-yl)propanoic acid has a molecular weight of 213.23 g/mol, XLogP of 0.24, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-cyclopropyl-5-oxomorpholin-3-yl)propanoic acid is sourced from PubChem (CID 115060435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).