2-amino-2-ethyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)butanamide

C9H16N4O2 — CID 21154901

IUPAC2-amino-2-ethyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)butanamide
SMILESCCC(N)(CC)C(=O)Nc1nnc(C)o1
InChIInChI=1S/C9H16N4O2/c1-4-9(10,5-2)7(14)11-8-13-12-6(3)15-8/h4-5,10H2,1-3H3,(H,11,13,14)
InChIKeyMCANMDGMEJZKFS-UHFFFAOYSA-N
MW212.25 g/mol
LogP0.83
Rot. Bonds4

About 2-amino-2-ethyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)butanamide

2-amino-2-ethyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)butanamide (PubChem CID 21154901) has the molecular formula C9H16N4O2 and a molecular weight of 212.25 g/mol. Its IUPAC name is 2-amino-2-ethyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)butanamide.

Molecular Properties

Compound Name2-amino-2-ethyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)butanamide
PubChem CID21154901
Molecular FormulaC9H16N4O2
Molecular Weight212.25 g/mol
Exact Mass212.13
IUPAC Name2-amino-2-ethyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)butanamide
SMILESCCC(N)(CC)C(=O)Nc1nnc(C)o1
InChIInChI=1S/C9H16N4O2/c1-4-9(10,5-2)7(14)11-8-13-12-6(3)15-8/h4-5,10H2,1-3H3,(H,11,13,14)
InChIKeyMCANMDGMEJZKFS-UHFFFAOYSA-N
XLogP0.83
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(5-methyl-1,3,4-oxadiazol-2-yl)carbamoyl]acetamide
CID 175502684
3,5-dibromo-N-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide
CID 107980577
2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
CID 39063542
2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
CID 78964193
2-[1-hydroxypropan-2-yl(methyl)amino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
CID 104554098
[2-[(5-methyl-1,3,4-oxadiazol-2-yl)amino]-2-oxoethyl] carbamimidothioate
CID 65211655
N-ethyl-5-methyl-1,3,4-oxadiazol-2-amine
CID 88975148
2,5-dimethyl-1,3,4-oxadiazole;propane
CID 143140950
(5-methyl-1,3,4-oxadiazol-2-yl)carbamodithioic acid
CID 87125746
1-cyclobutyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)urea
CID 116658027
2-amino-2-ethyl-N-(1,2-oxazol-4-yl)butanamide
CID 79815107
2,6-dihydroxy-N-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide
CID 107689655

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-ethyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)butanamide?
The IUPAC name of 2-amino-2-ethyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)butanamide (CID 21154901) is 2-amino-2-ethyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)butanamide.
What is the SMILES notation for 2-amino-2-ethyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)butanamide?
The canonical SMILES for 2-amino-2-ethyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)butanamide is CCC(N)(CC)C(=O)Nc1nnc(C)o1.
What is the InChIKey of 2-amino-2-ethyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)butanamide?
The InChIKey is MCANMDGMEJZKFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O2/c1-4-9(10,5-2)7(14)11-8-13-12-6(3)15-8/h4-5,10H2,1-3H3,(H,11,13,14).
What are the key properties of 2-amino-2-ethyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)butanamide?
2-amino-2-ethyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)butanamide has a molecular weight of 212.25 g/mol, XLogP of 0.83, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-ethyl-N-(5-methyl-1,3,4-oxadiazol-2-yl)butanamide is sourced from PubChem (CID 21154901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).