2-amino-3,3-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide

C15H19N3O2 — CID 76888066

IUPAC2-amino-3,3-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide
SMILESCC(C)(C)C(N)C(=O)Nc1cccc(-c2cnco2)c1
InChIInChI=1S/C15H19N3O2/c1-15(2,3)13(16)14(19)18-11-6-4-5-10(7-11)12-8-17-9-20-12/h4-9,13H,16H2,1-3H3,(H,18,19)
InChIKeyVSODLNNWCRYIPM-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.65
Rot. Bonds3

About 2-amino-3,3-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide

2-amino-3,3-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide (PubChem CID 76888066) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 2-amino-3,3-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide.

Molecular Properties

Compound Name2-amino-3,3-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide
PubChem CID76888066
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name2-amino-3,3-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide
SMILESCC(C)(C)C(N)C(=O)Nc1cccc(-c2cnco2)c1
InChIInChI=1S/C15H19N3O2/c1-15(2,3)13(16)14(19)18-11-6-4-5-10(7-11)12-8-17-9-20-12/h4-9,13H,16H2,1-3H3,(H,18,19)
InChIKeyVSODLNNWCRYIPM-UHFFFAOYSA-N
XLogP2.65
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide
CID 47265687
(2S)-2-amino-4-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pentanamide
CID 61180352
2-amino-N-[3-(1,3-oxazol-5-yl)phenyl]hexanamide
CID 60926904
3-amino-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide
CID 54862859
(2R)-2-amino-3,3-dimethyl-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]butanamide
CID 103929614
(2S)-N-tert-butyl-2-[[3-(1,3-oxazol-5-yl)phenyl]carbamoylamino]propanamide
CID 95338904
2-(ethylamino)-2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide
CID 62835671
5-amino-N-[3-(1,3-oxazol-5-yl)phenyl]hexanamide
CID 82851895
2-(methylamino)-N-[3-(1,3-oxazol-5-yl)phenyl]-3-phenylpropanamide
CID 123157870
3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]but-2-enamide
CID 47353684
2-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide
CID 63678754
N-(3-acetamidophenyl)-2-amino-3,3-dimethylbutanamide
CID 76891982

Frequently Asked Questions

What is the IUPAC name of 2-amino-3,3-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide?
The IUPAC name of 2-amino-3,3-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide (CID 76888066) is 2-amino-3,3-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide.
What is the SMILES notation for 2-amino-3,3-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide?
The canonical SMILES for 2-amino-3,3-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide is CC(C)(C)C(N)C(=O)Nc1cccc(-c2cnco2)c1.
What is the InChIKey of 2-amino-3,3-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide?
The InChIKey is VSODLNNWCRYIPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-15(2,3)13(16)14(19)18-11-6-4-5-10(7-11)12-8-17-9-20-12/h4-9,13H,16H2,1-3H3,(H,18,19).
What are the key properties of 2-amino-3,3-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide?
2-amino-3,3-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide has a molecular weight of 273.34 g/mol, XLogP of 2.65, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3,3-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide is sourced from PubChem (CID 76888066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).