(2R)-4-phenylmorpholine-2-carboxylic acid

C11H13NO3 — CID 95804269

IUPAC(2R)-4-phenylmorpholine-2-carboxylic acid
SMILESO=C(O)[C@H]1CN(c2ccccc2)CCO1
InChIInChI=1S/C11H13NO3/c13-11(14)10-8-12(6-7-15-10)9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H,13,14)/t10-/m1/s1
InChIKeyIFNYQASIGKYJTJ-SNVBAGLBSA-N
MW207.23 g/mol
LogP0.98
Rot. Bonds2

About (2R)-4-phenylmorpholine-2-carboxylic acid

(2R)-4-phenylmorpholine-2-carboxylic acid (PubChem CID 95804269) has the molecular formula C11H13NO3 and a molecular weight of 207.23 g/mol. Its IUPAC name is (2R)-4-phenylmorpholine-2-carboxylic acid.

Molecular Properties

Compound Name(2R)-4-phenylmorpholine-2-carboxylic acid
PubChem CID95804269
Molecular FormulaC11H13NO3
Molecular Weight207.23 g/mol
Exact Mass207.09
IUPAC Name(2R)-4-phenylmorpholine-2-carboxylic acid
SMILESO=C(O)[C@H]1CN(c2ccccc2)CCO1
InChIInChI=1S/C11H13NO3/c13-11(14)10-8-12(6-7-15-10)9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H,13,14)/t10-/m1/s1
InChIKeyIFNYQASIGKYJTJ-SNVBAGLBSA-N
XLogP0.98
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-4-(3-fluorophenyl)morpholine-2-carboxylic acid
CID 95804351
4-(2,6-dimethylphenyl)morpholine-2-carboxylic acid
CID 117008757
4-(2,3-dihydro-1,4-benzodioxin-6-yl)morpholine-2-carboxylic acid
CID 117008801
(2R)-N-(oxan-4-ylmethyl)-4-phenylmorpholine-2-carboxamide
CID 95813104
4-[(2S)-4-phenylmorpholine-2-carbonyl]piperazin-2-one
CID 95813093
4-(1-phenyl-1,2,4-triazole-3-carbonyl)morpholine-2-carboxylic acid
CID 120526060
(2S)-4-(1-phenylpyrazole-3-carbonyl)morpholine-2-carboxylic acid
CID 125148641
N-[(1R)-1-naphthalen-1-ylethyl]-4-phenylmorpholine-2-carboxamide
CID 121458579
N-[(4-phenylmorpholin-2-yl)methyl]acetamide
CID 70790066
4-(3-chloro-2-methylphenyl)morpholine-2-carboxylic acid
CID 117008772
4-(1-phenyltriazole-4-carbonyl)morpholine-2-carboxylic acid
CID 119239902
4-[(E)-3-(4-morpholin-4-ylphenyl)prop-2-enoyl]morpholine-2-carboxylic acid
CID 129009152

Frequently Asked Questions

What is the IUPAC name of (2R)-4-phenylmorpholine-2-carboxylic acid?
The IUPAC name of (2R)-4-phenylmorpholine-2-carboxylic acid (CID 95804269) is (2R)-4-phenylmorpholine-2-carboxylic acid.
What is the SMILES notation for (2R)-4-phenylmorpholine-2-carboxylic acid?
The canonical SMILES for (2R)-4-phenylmorpholine-2-carboxylic acid is O=C(O)[C@H]1CN(c2ccccc2)CCO1.
What is the InChIKey of (2R)-4-phenylmorpholine-2-carboxylic acid?
The InChIKey is IFNYQASIGKYJTJ-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H13NO3/c13-11(14)10-8-12(6-7-15-10)9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H,13,14)/t10-/m1/s1.
What are the key properties of (2R)-4-phenylmorpholine-2-carboxylic acid?
(2R)-4-phenylmorpholine-2-carboxylic acid has a molecular weight of 207.23 g/mol, XLogP of 0.98, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-phenylmorpholine-2-carboxylic acid is sourced from PubChem (CID 95804269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).