2-[4-[(2R)-oxolane-2-carbonyl]morpholin-3-yl]acetic acid

C11H17NO5 — CID 104855859

IUPAC2-[4-[(2R)-oxolane-2-carbonyl]morpholin-3-yl]acetic acid
SMILESO=C(O)CC1COCCN1C(=O)[C@H]1CCCO1
InChIInChI=1S/C11H17NO5/c13-10(14)6-8-7-16-5-3-12(8)11(15)9-2-1-4-17-9/h8-9H,1-7H2,(H,13,14)/t8?,9-/m1/s1
InChIKeyJMRRIQTURAKUKE-YGPZHTELSA-N
MW243.26 g/mol
LogP-0.13
Rot. Bonds3

About 2-[4-[(2R)-oxolane-2-carbonyl]morpholin-3-yl]acetic acid

2-[4-[(2R)-oxolane-2-carbonyl]morpholin-3-yl]acetic acid (PubChem CID 104855859) has the molecular formula C11H17NO5 and a molecular weight of 243.26 g/mol. Its IUPAC name is 2-[4-[(2R)-oxolane-2-carbonyl]morpholin-3-yl]acetic acid.

Molecular Properties

Compound Name2-[4-[(2R)-oxolane-2-carbonyl]morpholin-3-yl]acetic acid
PubChem CID104855859
Molecular FormulaC11H17NO5
Molecular Weight243.26 g/mol
Exact Mass243.11
IUPAC Name2-[4-[(2R)-oxolane-2-carbonyl]morpholin-3-yl]acetic acid
SMILESO=C(O)CC1COCCN1C(=O)[C@H]1CCCO1
InChIInChI=1S/C11H17NO5/c13-10(14)6-8-7-16-5-3-12(8)11(15)9-2-1-4-17-9/h8-9H,1-7H2,(H,13,14)/t8?,9-/m1/s1
InChIKeyJMRRIQTURAKUKE-YGPZHTELSA-N
XLogP-0.13
TPSA76.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.26
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-[(2R)-oxolane-2-carbonyl]pyrrolidin-2-yl]acetic acid
CID 104855615
4-[(2R)-oxolane-2-carbonyl]morpholine-3-carboxylic acid
CID 104855782
2-[1-(1,4-dioxane-2-carbonyl)piperidin-2-yl]acetic acid
CID 54899293
2-[(3R)-4-[(1S)-2,2-dimethylcyclopropanecarbonyl]morpholin-3-yl]acetic acid
CID 129414261
3-[1-(oxolane-2-carbonyl)piperidin-2-yl]propanoic acid
CID 62217275
2-[4-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-3-carbonyl)morpholin-3-yl]acetic acid
CID 102893391
[2-(hydroxymethyl)pyrrolidin-1-yl]-(oxolan-2-yl)methanone
CID 61410730
[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]-(oxolan-2-yl)methanone
CID 79030400
2-[4-(2,3,3a,4,5,6,7,7a-octahydroindole-1-carbonyl)morpholin-3-yl]acetic acid
CID 82753207
2-[(3R)-4-[1-(pyridine-4-carbonyl)piperidine-4-carbonyl]morpholin-3-yl]acetic acid
CID 95728578
2-[4-(1,4-dioxane-2-carbonyl)-1,1-dioxo-1,4-thiazinan-3-yl]acetic acid
CID 80518710
2-[(3S)-4-[3-(oxan-4-yl)propanoyl]morpholin-3-yl]acetic acid
CID 129470037

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(2R)-oxolane-2-carbonyl]morpholin-3-yl]acetic acid?
The IUPAC name of 2-[4-[(2R)-oxolane-2-carbonyl]morpholin-3-yl]acetic acid (CID 104855859) is 2-[4-[(2R)-oxolane-2-carbonyl]morpholin-3-yl]acetic acid.
What is the SMILES notation for 2-[4-[(2R)-oxolane-2-carbonyl]morpholin-3-yl]acetic acid?
The canonical SMILES for 2-[4-[(2R)-oxolane-2-carbonyl]morpholin-3-yl]acetic acid is O=C(O)CC1COCCN1C(=O)[C@H]1CCCO1.
What is the InChIKey of 2-[4-[(2R)-oxolane-2-carbonyl]morpholin-3-yl]acetic acid?
The InChIKey is JMRRIQTURAKUKE-YGPZHTELSA-N. The full InChI is InChI=1S/C11H17NO5/c13-10(14)6-8-7-16-5-3-12(8)11(15)9-2-1-4-17-9/h8-9H,1-7H2,(H,13,14)/t8?,9-/m1/s1.
What are the key properties of 2-[4-[(2R)-oxolane-2-carbonyl]morpholin-3-yl]acetic acid?
2-[4-[(2R)-oxolane-2-carbonyl]morpholin-3-yl]acetic acid has a molecular weight of 243.26 g/mol, XLogP of -0.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(2R)-oxolane-2-carbonyl]morpholin-3-yl]acetic acid is sourced from PubChem (CID 104855859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).