(2R)-2-[[2-(2-phenyl-1,3-oxazol-4-yl)acetyl]amino]propanamide

C14H15N3O3 — CID 94483610

IUPAC(2R)-2-[[2-(2-phenyl-1,3-oxazol-4-yl)acetyl]amino]propanamide
SMILESC[C@@H](NC(=O)Cc1coc(-c2ccccc2)n1)C(N)=O
InChIInChI=1S/C14H15N3O3/c1-9(13(15)19)16-12(18)7-11-8-20-14(17-11)10-5-3-2-4-6-10/h2-6,8-9H,7H2,1H3,(H2,15,19)(H,16,18)/t9-/m1/s1
InChIKeySZLWSUAVEVCZDC-SECBINFHSA-N
MW273.29 g/mol
LogP0.87
Rot. Bonds5

About (2R)-2-[[2-(2-phenyl-1,3-oxazol-4-yl)acetyl]amino]propanamide

(2R)-2-[[2-(2-phenyl-1,3-oxazol-4-yl)acetyl]amino]propanamide (PubChem CID 94483610) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is (2R)-2-[[2-(2-phenyl-1,3-oxazol-4-yl)acetyl]amino]propanamide.

Molecular Properties

Compound Name(2R)-2-[[2-(2-phenyl-1,3-oxazol-4-yl)acetyl]amino]propanamide
PubChem CID94483610
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC Name(2R)-2-[[2-(2-phenyl-1,3-oxazol-4-yl)acetyl]amino]propanamide
SMILESC[C@@H](NC(=O)Cc1coc(-c2ccccc2)n1)C(N)=O
InChIInChI=1S/C14H15N3O3/c1-9(13(15)19)16-12(18)7-11-8-20-14(17-11)10-5-3-2-4-6-10/h2-6,8-9H,7H2,1H3,(H2,15,19)(H,16,18)/t9-/m1/s1
InChIKeySZLWSUAVEVCZDC-SECBINFHSA-N
XLogP0.87
TPSA98.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-[[2-(2-phenyl-1,3-oxazol-4-yl)acetyl]amino]propanamide?
The IUPAC name of (2R)-2-[[2-(2-phenyl-1,3-oxazol-4-yl)acetyl]amino]propanamide (CID 94483610) is (2R)-2-[[2-(2-phenyl-1,3-oxazol-4-yl)acetyl]amino]propanamide.
What is the SMILES notation for (2R)-2-[[2-(2-phenyl-1,3-oxazol-4-yl)acetyl]amino]propanamide?
The canonical SMILES for (2R)-2-[[2-(2-phenyl-1,3-oxazol-4-yl)acetyl]amino]propanamide is C[C@@H](NC(=O)Cc1coc(-c2ccccc2)n1)C(N)=O.
What is the InChIKey of (2R)-2-[[2-(2-phenyl-1,3-oxazol-4-yl)acetyl]amino]propanamide?
The InChIKey is SZLWSUAVEVCZDC-SECBINFHSA-N. The full InChI is InChI=1S/C14H15N3O3/c1-9(13(15)19)16-12(18)7-11-8-20-14(17-11)10-5-3-2-4-6-10/h2-6,8-9H,7H2,1H3,(H2,15,19)(H,16,18)/t9-/m1/s1.
What are the key properties of (2R)-2-[[2-(2-phenyl-1,3-oxazol-4-yl)acetyl]amino]propanamide?
(2R)-2-[[2-(2-phenyl-1,3-oxazol-4-yl)acetyl]amino]propanamide has a molecular weight of 273.29 g/mol, XLogP of 0.87, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[[2-(2-phenyl-1,3-oxazol-4-yl)acetyl]amino]propanamide is sourced from PubChem (CID 94483610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).