2-amino-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide

C8H14N4O2 — CID 61266032

IUPAC2-amino-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide
SMILESCc1noc(CNC(=O)C(C)(C)N)n1
InChIInChI=1S/C8H14N4O2/c1-5-11-6(14-12-5)4-10-7(13)8(2,3)9/h4,9H2,1-3H3,(H,10,13)
InChIKeyZTUVPMGLGQZEAS-UHFFFAOYSA-N
MW198.23 g/mol
LogP-0.27
Rot. Bonds3

About 2-amino-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide

2-amino-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide (PubChem CID 61266032) has the molecular formula C8H14N4O2 and a molecular weight of 198.23 g/mol. Its IUPAC name is 2-amino-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide.

Molecular Properties

Compound Name2-amino-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide
PubChem CID61266032
Molecular FormulaC8H14N4O2
Molecular Weight198.23 g/mol
Exact Mass198.11
IUPAC Name2-amino-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide
SMILESCc1noc(CNC(=O)C(C)(C)N)n1
InChIInChI=1S/C8H14N4O2/c1-5-11-6(14-12-5)4-10-7(13)8(2,3)9/h4,9H2,1-3H3,(H,10,13)
InChIKeyZTUVPMGLGQZEAS-UHFFFAOYSA-N
XLogP-0.27
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 5-0.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide?
The IUPAC name of 2-amino-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide (CID 61266032) is 2-amino-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide.
What is the SMILES notation for 2-amino-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide?
The canonical SMILES for 2-amino-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide is Cc1noc(CNC(=O)C(C)(C)N)n1.
What is the InChIKey of 2-amino-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide?
The InChIKey is ZTUVPMGLGQZEAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O2/c1-5-11-6(14-12-5)4-10-7(13)8(2,3)9/h4,9H2,1-3H3,(H,10,13).
What are the key properties of 2-amino-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide?
2-amino-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide has a molecular weight of 198.23 g/mol, XLogP of -0.27, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]propanamide is sourced from PubChem (CID 61266032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).