(2S)-N-[3-(1,3-oxazol-2-yl)phenyl]-2-phenylmorpholine-4-carboxamide

C20H19N3O3 — CID 124614069

IUPAC(2S)-N-[3-(1,3-oxazol-2-yl)phenyl]-2-phenylmorpholine-4-carboxamide
SMILESO=C(Nc1cccc(-c2ncco2)c1)N1CCO[C@@H](c2ccccc2)C1
InChIInChI=1S/C20H19N3O3/c24-20(22-17-8-4-7-16(13-17)19-21-9-11-26-19)23-10-12-25-18(14-23)15-5-2-1-3-6-15/h1-9,11,13,18H,10,12,14H2,(H,22,24)/t18-/m1/s1
InChIKeyKYWNUTOPONLUHY-GOSISDBHSA-N
MW349.39 g/mol
LogP3.95
Rot. Bonds3

About (2S)-N-[3-(1,3-oxazol-2-yl)phenyl]-2-phenylmorpholine-4-carboxamide

(2S)-N-[3-(1,3-oxazol-2-yl)phenyl]-2-phenylmorpholine-4-carboxamide (PubChem CID 124614069) has the molecular formula C20H19N3O3 and a molecular weight of 349.39 g/mol. Its IUPAC name is (2S)-N-[3-(1,3-oxazol-2-yl)phenyl]-2-phenylmorpholine-4-carboxamide.

Molecular Properties

Compound Name(2S)-N-[3-(1,3-oxazol-2-yl)phenyl]-2-phenylmorpholine-4-carboxamide
PubChem CID124614069
Molecular FormulaC20H19N3O3
Molecular Weight349.39 g/mol
Exact Mass349.14
IUPAC Name(2S)-N-[3-(1,3-oxazol-2-yl)phenyl]-2-phenylmorpholine-4-carboxamide
SMILESO=C(Nc1cccc(-c2ncco2)c1)N1CCO[C@@H](c2ccccc2)C1
InChIInChI=1S/C20H19N3O3/c24-20(22-17-8-4-7-16(13-17)19-21-9-11-26-19)23-10-12-25-18(14-23)15-5-2-1-3-6-15/h1-9,11,13,18H,10,12,14H2,(H,22,24)/t18-/m1/s1
InChIKeyKYWNUTOPONLUHY-GOSISDBHSA-N
XLogP3.95
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-acetyl-N-[3-(1,3-oxazol-2-yl)phenyl]piperazine-1-carboxamide
CID 75388652
(2S)-N-(3-nitrophenyl)-2-phenylmorpholine-4-carboxamide
CID 32840083
4-(2,5-dihydropyrrol-1-yl)-N-[3-(1,3-oxazol-2-yl)phenyl]piperidine-1-carboxamide
CID 86803982
N-phenyl-4-(2-phenylmorpholine-4-carbonyl)piperidine-1-carboxamide
CID 128925946
N-(3-fluoro-4-methylphenyl)-2-phenylmorpholine-4-carboxamide
CID 86987031
N-(4-ethylphenyl)-2-phenylmorpholine-4-carboxamide
CID 84526380
2-(4-chlorophenyl)-N-(3-ethynylphenyl)morpholine-4-carboxamide
CID 87035094
(2S)-2-phenyl-N-(3-phenyl-1,2,4-thiadiazol-5-yl)morpholine-4-carboxamide
CID 97201689
(2S)-N-(1,3-benzodioxol-5-yl)-2-pyridin-3-ylmorpholine-4-carboxamide
CID 97105209
2-(4-fluorophenyl)-N-(3-methoxyphenyl)morpholine-4-carboxamide
CID 84524231
N-(3-chlorophenyl)-2-(4-methoxyphenyl)morpholine-4-carboxamide
CID 110327203
[(2R)-2-phenylmorpholin-4-yl]-pyrazin-2-ylmethanone
CID 31414918

Frequently Asked Questions

What is the IUPAC name of (2S)-N-[3-(1,3-oxazol-2-yl)phenyl]-2-phenylmorpholine-4-carboxamide?
The IUPAC name of (2S)-N-[3-(1,3-oxazol-2-yl)phenyl]-2-phenylmorpholine-4-carboxamide (CID 124614069) is (2S)-N-[3-(1,3-oxazol-2-yl)phenyl]-2-phenylmorpholine-4-carboxamide.
What is the SMILES notation for (2S)-N-[3-(1,3-oxazol-2-yl)phenyl]-2-phenylmorpholine-4-carboxamide?
The canonical SMILES for (2S)-N-[3-(1,3-oxazol-2-yl)phenyl]-2-phenylmorpholine-4-carboxamide is O=C(Nc1cccc(-c2ncco2)c1)N1CCO[C@@H](c2ccccc2)C1.
What is the InChIKey of (2S)-N-[3-(1,3-oxazol-2-yl)phenyl]-2-phenylmorpholine-4-carboxamide?
The InChIKey is KYWNUTOPONLUHY-GOSISDBHSA-N. The full InChI is InChI=1S/C20H19N3O3/c24-20(22-17-8-4-7-16(13-17)19-21-9-11-26-19)23-10-12-25-18(14-23)15-5-2-1-3-6-15/h1-9,11,13,18H,10,12,14H2,(H,22,24)/t18-/m1/s1.
What are the key properties of (2S)-N-[3-(1,3-oxazol-2-yl)phenyl]-2-phenylmorpholine-4-carboxamide?
(2S)-N-[3-(1,3-oxazol-2-yl)phenyl]-2-phenylmorpholine-4-carboxamide has a molecular weight of 349.39 g/mol, XLogP of 3.95, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[3-(1,3-oxazol-2-yl)phenyl]-2-phenylmorpholine-4-carboxamide is sourced from PubChem (CID 124614069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).