2-amino-N-(1,2-oxazol-3-yl)-3-phenylpropanamide

C12H13N3O2 — CID 62903425

IUPAC2-amino-N-(1,2-oxazol-3-yl)-3-phenylpropanamide
SMILESNC(Cc1ccccc1)C(=O)Nc1ccon1
InChIInChI=1S/C12H13N3O2/c13-10(8-9-4-2-1-3-5-9)12(16)14-11-6-7-17-15-11/h1-7,10H,8,13H2,(H,14,15,16)
InChIKeyQFQKYQYOLZGEDV-UHFFFAOYSA-N
MW231.26 g/mol
LogP1.18
Rot. Bonds4

About 2-amino-N-(1,2-oxazol-3-yl)-3-phenylpropanamide

2-amino-N-(1,2-oxazol-3-yl)-3-phenylpropanamide (PubChem CID 62903425) has the molecular formula C12H13N3O2 and a molecular weight of 231.26 g/mol. Its IUPAC name is 2-amino-N-(1,2-oxazol-3-yl)-3-phenylpropanamide.

Molecular Properties

Compound Name2-amino-N-(1,2-oxazol-3-yl)-3-phenylpropanamide
PubChem CID62903425
Molecular FormulaC12H13N3O2
Molecular Weight231.26 g/mol
Exact Mass231.10
IUPAC Name2-amino-N-(1,2-oxazol-3-yl)-3-phenylpropanamide
SMILESNC(Cc1ccccc1)C(=O)Nc1ccon1
InChIInChI=1S/C12H13N3O2/c13-10(8-9-4-2-1-3-5-9)12(16)14-11-6-7-17-15-11/h1-7,10H,8,13H2,(H,14,15,16)
InChIKeyQFQKYQYOLZGEDV-UHFFFAOYSA-N
XLogP1.18
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.26
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-amino-N-[(2S)-2-amino-3-phenylpropanoyl]-3-phenylpropanamide
CID 21116073
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CID 104893301
(2R)-2-amino-3-phenyl-N-(1,3,4-thiadiazol-2-yl)propanamide;hydrochloride
CID 70531106
(2S)-N-(3-acetamidophenyl)-2-amino-3-phenylpropanamide
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(2S)-2-amino-N-(5-bromo-6-methyl-2-pyridinyl)-3-phenylpropanamide
CID 79048264
(2R)-2-amino-N-(2,3,4,5,6-pentamethylphenyl)-3-phenylpropanamide
CID 124864491
2-amino-N-naphthalen-2-yl-3-phenylpropanamide
CID 577793
(2S)-2-amino-N-(2-methylphenyl)-3-phenylpropanamide
CID 22691205
(2R)-2-amino-N-(4-iodophenyl)-3-phenylpropanamide
CID 28976654
4-[(2-amino-3-phenylpropanoyl)amino]benzoic acid
CID 22161473
2-amino-N-(3-iodophenyl)-3-phenylpropanamide
CID 43124635
(2S)-2-amino-N-(3-methylphenyl)-3-phenylpropanamide
CID 22691206

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1,2-oxazol-3-yl)-3-phenylpropanamide?
The IUPAC name of 2-amino-N-(1,2-oxazol-3-yl)-3-phenylpropanamide (CID 62903425) is 2-amino-N-(1,2-oxazol-3-yl)-3-phenylpropanamide.
What is the SMILES notation for 2-amino-N-(1,2-oxazol-3-yl)-3-phenylpropanamide?
The canonical SMILES for 2-amino-N-(1,2-oxazol-3-yl)-3-phenylpropanamide is NC(Cc1ccccc1)C(=O)Nc1ccon1.
What is the InChIKey of 2-amino-N-(1,2-oxazol-3-yl)-3-phenylpropanamide?
The InChIKey is QFQKYQYOLZGEDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O2/c13-10(8-9-4-2-1-3-5-9)12(16)14-11-6-7-17-15-11/h1-7,10H,8,13H2,(H,14,15,16).
What are the key properties of 2-amino-N-(1,2-oxazol-3-yl)-3-phenylpropanamide?
2-amino-N-(1,2-oxazol-3-yl)-3-phenylpropanamide has a molecular weight of 231.26 g/mol, XLogP of 1.18, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1,2-oxazol-3-yl)-3-phenylpropanamide is sourced from PubChem (CID 62903425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).