3-[[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]-2,2-dimethylpropanamide

C10H19N5O2 — CID 114167814

IUPAC3-[[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]-2,2-dimethylpropanamide
SMILESCCNCc1nnc(NCC(C)(C)C(N)=O)o1
InChIInChI=1S/C10H19N5O2/c1-4-12-5-7-14-15-9(17-7)13-6-10(2,3)8(11)16/h12H,4-6H2,1-3H3,(H2,11,16)(H,13,15)
InChIKeyGFVVSIRJZBEIDF-UHFFFAOYSA-N
MW241.29 g/mol
LogP0.10
Rot. Bonds7

About 3-[[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]-2,2-dimethylpropanamide

3-[[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]-2,2-dimethylpropanamide (PubChem CID 114167814) has the molecular formula C10H19N5O2 and a molecular weight of 241.29 g/mol. Its IUPAC name is 3-[[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]-2,2-dimethylpropanamide.

Molecular Properties

Compound Name3-[[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]-2,2-dimethylpropanamide
PubChem CID114167814
Molecular FormulaC10H19N5O2
Molecular Weight241.29 g/mol
Exact Mass241.15
IUPAC Name3-[[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]-2,2-dimethylpropanamide
SMILESCCNCc1nnc(NCC(C)(C)C(N)=O)o1
InChIInChI=1S/C10H19N5O2/c1-4-12-5-7-14-15-9(17-7)13-6-10(2,3)8(11)16/h12H,4-6H2,1-3H3,(H2,11,16)(H,13,15)
InChIKeyGFVVSIRJZBEIDF-UHFFFAOYSA-N
XLogP0.10
TPSA106.07 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 50.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

3-[[5-[(2-methoxyethylamino)methyl]-1,3,4-oxadiazol-2-yl]amino]-2,2-dimethylpropanamide
CID 106280983
3-[[5-[1-(ethylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]-2,2-dimethylpropanamide
CID 114167811
2-[[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]propanamide
CID 106964121
3-[[5-[(cyclopropylamino)methyl]-1,3,4-oxadiazol-2-yl]amino]-N,2,2-trimethylpropanamide
CID 106281003
5-(ethylaminomethyl)-N-(2-methylbutyl)-1,3,4-oxadiazol-2-amine
CID 106960518
5-(ethylaminomethyl)-N-[(4-ethylphenyl)methyl]-1,3,4-oxadiazol-2-amine
CID 106967437
2,2-dimethyl-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]propanamide
CID 106276224
N-[(5-tert-butyl-1,3,4-oxadiazol-2-yl)methyl]ethanamine
CID 62138113
N-ethyl-3-[[5-(propylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]propanamide
CID 106964337
3-methyl-3-[[5-(propylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]butanamide
CID 106098974
5-(ethylaminomethyl)-N-(5-methylhexyl)-1,3,4-oxadiazol-2-amine
CID 106963651
2-[[5-[(2-methylpropylamino)methyl]-1,3,4-oxadiazol-2-yl]amino]acetamide
CID 106967726

Frequently Asked Questions

What is the IUPAC name of 3-[[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]-2,2-dimethylpropanamide?
The IUPAC name of 3-[[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]-2,2-dimethylpropanamide (CID 114167814) is 3-[[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]-2,2-dimethylpropanamide.
What is the SMILES notation for 3-[[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]-2,2-dimethylpropanamide?
The canonical SMILES for 3-[[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]-2,2-dimethylpropanamide is CCNCc1nnc(NCC(C)(C)C(N)=O)o1.
What is the InChIKey of 3-[[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]-2,2-dimethylpropanamide?
The InChIKey is GFVVSIRJZBEIDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O2/c1-4-12-5-7-14-15-9(17-7)13-6-10(2,3)8(11)16/h12H,4-6H2,1-3H3,(H2,11,16)(H,13,15).
What are the key properties of 3-[[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]-2,2-dimethylpropanamide?
3-[[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]-2,2-dimethylpropanamide has a molecular weight of 241.29 g/mol, XLogP of 0.10, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]-2,2-dimethylpropanamide is sourced from PubChem (CID 114167814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).