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

C11H19N3O2 — CID 106388299

IUPAC3-amino-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]butanamide
SMILESCc1cnc(C(C)NC(=O)CC(C)(C)N)o1
InChIInChI=1S/C11H19N3O2/c1-7-6-13-10(16-7)8(2)14-9(15)5-11(3,4)12/h6,8H,5,12H2,1-4H3,(H,14,15)
InChIKeyHIDRITCZASIWKJ-UHFFFAOYSA-N
MW225.29 g/mol
LogP1.29
Rot. Bonds4

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

3-amino-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]butanamide (PubChem CID 106388299) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is 3-amino-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]butanamide.

Molecular Properties

Compound Name3-amino-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]butanamide
PubChem CID106388299
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC Name3-amino-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]butanamide
SMILESCc1cnc(C(C)NC(=O)CC(C)(C)N)o1
InChIInChI=1S/C11H19N3O2/c1-7-6-13-10(16-7)8(2)14-9(15)5-11(3,4)12/h6,8H,5,12H2,1-4H3,(H,14,15)
InChIKeyHIDRITCZASIWKJ-UHFFFAOYSA-N
XLogP1.29
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-amino-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]butanamide?
The IUPAC name of 3-amino-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]butanamide (CID 106388299) is 3-amino-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]butanamide.
What is the SMILES notation for 3-amino-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]butanamide?
The canonical SMILES for 3-amino-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]butanamide is Cc1cnc(C(C)NC(=O)CC(C)(C)N)o1.
What is the InChIKey of 3-amino-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]butanamide?
The InChIKey is HIDRITCZASIWKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-7-6-13-10(16-7)8(2)14-9(15)5-11(3,4)12/h6,8H,5,12H2,1-4H3,(H,14,15).
What are the key properties of 3-amino-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]butanamide?
3-amino-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]butanamide has a molecular weight of 225.29 g/mol, XLogP of 1.29, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]butanamide is sourced from PubChem (CID 106388299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).