N-[(1S)-2-hydroxy-1-phenylethyl]morpholine-3-carboxamide

C13H18N2O3 — CID 107862923

IUPACN-[(1S)-2-hydroxy-1-phenylethyl]morpholine-3-carboxamide
SMILESO=C(N[C@H](CO)c1ccccc1)C1COCCN1
InChIInChI=1S/C13H18N2O3/c16-8-11(10-4-2-1-3-5-10)15-13(17)12-9-18-7-6-14-12/h1-5,11-12,14,16H,6-9H2,(H,15,17)/t11-,12?/m1/s1
InChIKeySXEODGOBDTVABP-JHJMLUEUSA-N
MW250.30 g/mol
LogP-0.18
Rot. Bonds4

About N-[(1S)-2-hydroxy-1-phenylethyl]morpholine-3-carboxamide

N-[(1S)-2-hydroxy-1-phenylethyl]morpholine-3-carboxamide (PubChem CID 107862923) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is N-[(1S)-2-hydroxy-1-phenylethyl]morpholine-3-carboxamide.

Molecular Properties

Compound NameN-[(1S)-2-hydroxy-1-phenylethyl]morpholine-3-carboxamide
PubChem CID107862923
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC NameN-[(1S)-2-hydroxy-1-phenylethyl]morpholine-3-carboxamide
SMILESO=C(N[C@H](CO)c1ccccc1)C1COCCN1
InChIInChI=1S/C13H18N2O3/c16-8-11(10-4-2-1-3-5-10)15-13(17)12-9-18-7-6-14-12/h1-5,11-12,14,16H,6-9H2,(H,15,17)/t11-,12?/m1/s1
InChIKeySXEODGOBDTVABP-JHJMLUEUSA-N
XLogP-0.18
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 5-0.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(3R)-N-[(1S)-1-phenylethyl]morpholine-3-carboxamide
CID 16681349
N-[(1R)-2-hydroxy-1-phenylethyl]pyrrolidine-2-carboxamide
CID 107863240
N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]morpholine-3-carboxamide
CID 107861025
N-[(1R)-2-hydroxy-1-phenylethyl]-1,3-thiazolidine-4-carboxamide
CID 107863284
(2R)-3-hydroxy-2-(morpholine-3-carbonylamino)propanoic acid
CID 80750560
(2S)-2-(morpholine-3-carbonylamino)-4-phenylbutanoic acid
CID 104983382
4-hydroxy-N-[(1R)-2-hydroxy-1-phenylethyl]pyrrolidine-2-carboxamide
CID 114010288
N-[(2R)-1-hydroxypropan-2-yl]morpholine-3-carboxamide
CID 107218691
(3R)-N-[(2S)-2,3-diphenylpropyl]morpholine-3-carboxamide
CID 124699410
N-(1,1,1-trifluoro-3-phenylpropan-2-yl)morpholine-3-carboxamide;hydrochloride
CID 119801822
N-[1-(benzylamino)-1-oxopropan-2-yl]morpholine-3-carboxamide;hydrochloride
CID 119750954
N-(2-phenyl-2-pyrrolidin-1-ylethyl)morpholine-3-carboxamide;dihydrochloride
CID 119831374

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-2-hydroxy-1-phenylethyl]morpholine-3-carboxamide?
The IUPAC name of N-[(1S)-2-hydroxy-1-phenylethyl]morpholine-3-carboxamide (CID 107862923) is N-[(1S)-2-hydroxy-1-phenylethyl]morpholine-3-carboxamide.
What is the SMILES notation for N-[(1S)-2-hydroxy-1-phenylethyl]morpholine-3-carboxamide?
The canonical SMILES for N-[(1S)-2-hydroxy-1-phenylethyl]morpholine-3-carboxamide is O=C(N[C@H](CO)c1ccccc1)C1COCCN1.
What is the InChIKey of N-[(1S)-2-hydroxy-1-phenylethyl]morpholine-3-carboxamide?
The InChIKey is SXEODGOBDTVABP-JHJMLUEUSA-N. The full InChI is InChI=1S/C13H18N2O3/c16-8-11(10-4-2-1-3-5-10)15-13(17)12-9-18-7-6-14-12/h1-5,11-12,14,16H,6-9H2,(H,15,17)/t11-,12?/m1/s1.
What are the key properties of N-[(1S)-2-hydroxy-1-phenylethyl]morpholine-3-carboxamide?
N-[(1S)-2-hydroxy-1-phenylethyl]morpholine-3-carboxamide has a molecular weight of 250.30 g/mol, XLogP of -0.18, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-2-hydroxy-1-phenylethyl]morpholine-3-carboxamide is sourced from PubChem (CID 107862923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).