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

C11H19N3O2 — CID 106370868

IUPAC4-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylbutanamide
SMILESCCc1cnc(CNC(=O)C(C)CCN)o1
InChIInChI=1S/C11H19N3O2/c1-3-9-6-13-10(16-9)7-14-11(15)8(2)4-5-12/h6,8H,3-5,7,12H2,1-2H3,(H,14,15)
InChIKeyXNYXWZRRSRPDAJ-UHFFFAOYSA-N
MW225.29 g/mol
LogP0.84
Rot. Bonds6

About 4-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylbutanamide

4-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylbutanamide (PubChem CID 106370868) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is 4-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylbutanamide.

Molecular Properties

Compound Name4-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylbutanamide
PubChem CID106370868
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC Name4-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylbutanamide
SMILESCCc1cnc(CNC(=O)C(C)CCN)o1
InChIInChI=1S/C11H19N3O2/c1-3-9-6-13-10(16-9)7-14-11(15)8(2)4-5-12/h6,8H,3-5,7,12H2,1-2H3,(H,14,15)
InChIKeyXNYXWZRRSRPDAJ-UHFFFAOYSA-N
XLogP0.84
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylheptanamide
CID 106371015
(2S)-2-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]propanamide
CID 106371001
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-methyl-2-sulfanylbutanamide
CID 106377749
2-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3,3-dimethylbutanamide
CID 106370818
4-amino-5-[(5-ethyl-1,3-oxazol-2-yl)methylamino]-5-oxopentanoic acid
CID 106371131
2-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butanediamide
CID 106370829
2-(2-aminoethoxy)-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]acetamide
CID 106370910
methyl 3-[(5-ethyl-1,3-oxazol-2-yl)methylamino]-2-methylpropanoate
CID 106371286
2-amino-2-ethyl-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butanamide
CID 106370796
2-[(5-ethyl-1,3-oxazol-2-yl)methylamino]butanamide
CID 106371196
2-[(5-ethyl-1,3-oxazol-2-yl)methylcarbamoylamino]butanoic acid
CID 106374246
2-(aminomethyl)-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylbutanamide
CID 106370930

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylbutanamide?
The IUPAC name of 4-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylbutanamide (CID 106370868) is 4-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylbutanamide.
What is the SMILES notation for 4-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylbutanamide?
The canonical SMILES for 4-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylbutanamide is CCc1cnc(CNC(=O)C(C)CCN)o1.
What is the InChIKey of 4-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylbutanamide?
The InChIKey is XNYXWZRRSRPDAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-3-9-6-13-10(16-9)7-14-11(15)8(2)4-5-12/h6,8H,3-5,7,12H2,1-2H3,(H,14,15).
What are the key properties of 4-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylbutanamide?
4-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylbutanamide has a molecular weight of 225.29 g/mol, XLogP of 0.84, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylbutanamide is sourced from PubChem (CID 106370868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).