2-amino-2-ethyl-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butanamide

C12H21N3O2 — CID 106370796

IUPAC2-amino-2-ethyl-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butanamide
SMILESCCc1cnc(CNC(=O)C(N)(CC)CC)o1
InChIInChI=1S/C12H21N3O2/c1-4-9-7-14-10(17-9)8-15-11(16)12(13,5-2)6-3/h7H,4-6,8,13H2,1-3H3,(H,15,16)
InChIKeyZSTXIOUVBREHEY-UHFFFAOYSA-N
MW239.32 g/mol
LogP1.37
Rot. Bonds6

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

2-amino-2-ethyl-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butanamide (PubChem CID 106370796) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is 2-amino-2-ethyl-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butanamide.

Molecular Properties

Compound Name2-amino-2-ethyl-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butanamide
PubChem CID106370796
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC Name2-amino-2-ethyl-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butanamide
SMILESCCc1cnc(CNC(=O)C(N)(CC)CC)o1
InChIInChI=1S/C12H21N3O2/c1-4-9-7-14-10(17-9)8-15-11(16)12(13,5-2)6-3/h7H,4-6,8,13H2,1-3H3,(H,15,16)
InChIKeyZSTXIOUVBREHEY-UHFFFAOYSA-N
XLogP1.37
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(aminomethyl)-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylbutanamide
CID 106370930
(2S)-2-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]propanamide
CID 106371001
2-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3,3-dimethylbutanamide
CID 106370818
N-ethyl-2-[(5-ethyl-1,3-oxazol-2-yl)methylamino]acetamide
CID 106370872
2-(4-aminophenyl)-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]acetamide
CID 106368469
2-[(5-ethyl-1,3-oxazol-2-yl)methylcarbamoylamino]butanoic acid
CID 106374246
2-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butanediamide
CID 106370829
4-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylbutanamide
CID 106370868
1-(4-aminophenyl)-3-[(5-ethyl-1,3-oxazol-2-yl)methyl]urea
CID 106373291
4-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-5-methylthiophene-2-carboxamide
CID 106368458
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-methyl-2-sulfanylbutanamide
CID 106377749
2-(2-aminoethoxy)-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]acetamide
CID 106370910

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-ethyl-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butanamide?
The IUPAC name of 2-amino-2-ethyl-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butanamide (CID 106370796) is 2-amino-2-ethyl-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butanamide.
What is the SMILES notation for 2-amino-2-ethyl-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butanamide?
The canonical SMILES for 2-amino-2-ethyl-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butanamide is CCc1cnc(CNC(=O)C(N)(CC)CC)o1.
What is the InChIKey of 2-amino-2-ethyl-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butanamide?
The InChIKey is ZSTXIOUVBREHEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-4-9-7-14-10(17-9)8-15-11(16)12(13,5-2)6-3/h7H,4-6,8,13H2,1-3H3,(H,15,16).
What are the key properties of 2-amino-2-ethyl-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butanamide?
2-amino-2-ethyl-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butanamide has a molecular weight of 239.32 g/mol, XLogP of 1.37, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-ethyl-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butanamide is sourced from PubChem (CID 106370796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).