2-[[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-methylamino]-N-propan-2-ylacetamide

C10H19N5O2 — CID 106959440

IUPAC2-[[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-methylamino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CN(C)c1nnc(C(C)N)o1
InChIInChI=1S/C10H19N5O2/c1-6(2)12-8(16)5-15(4)10-14-13-9(17-10)7(3)11/h6-7H,5,11H2,1-4H3,(H,12,16)
InChIKeyOCQLJOTWXFBLFA-UHFFFAOYSA-N
MW241.29 g/mol
LogP0.05
Rot. Bonds5

About 2-[[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-methylamino]-N-propan-2-ylacetamide

2-[[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-methylamino]-N-propan-2-ylacetamide (PubChem CID 106959440) has the molecular formula C10H19N5O2 and a molecular weight of 241.29 g/mol. Its IUPAC name is 2-[[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-methylamino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-methylamino]-N-propan-2-ylacetamide
PubChem CID106959440
Molecular FormulaC10H19N5O2
Molecular Weight241.29 g/mol
Exact Mass241.15
IUPAC Name2-[[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-methylamino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CN(C)c1nnc(C(C)N)o1
InChIInChI=1S/C10H19N5O2/c1-6(2)12-8(16)5-15(4)10-14-13-9(17-10)7(3)11/h6-7H,5,11H2,1-4H3,(H,12,16)
InChIKeyOCQLJOTWXFBLFA-UHFFFAOYSA-N
XLogP0.05
TPSA97.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[methyl-[5-(propylaminomethyl)-1,3,4-oxadiazol-2-yl]amino]-N-propan-2-ylacetamide
CID 106959438
2-[[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]amino]-N-propan-2-ylacetamide
CID 106969317
2-[[5-(1-chloroethyl)-1,3,4-oxadiazol-2-yl]-methylamino]-N-(2-methylpropyl)acetamide
CID 106958431
5-(1-aminoethyl)-N-methyl-N-(3-methylbutyl)-1,3,4-oxadiazol-2-amine
CID 106971387
N-cyclopropyl-2-[methyl-[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]acetamide
CID 106971142
N,N-diethyl-2-[methyl-[5-[1-(methylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]acetamide
CID 106959465
2-[[6-(ethylamino)-5-propan-2-ylpyrimidin-4-yl]-methylamino]-N-propan-2-ylacetamide
CID 80787141
2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide
CID 60937489
2-[[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]amino]-N-ethylacetamide
CID 106969294
2-[(4-aminopyrimidin-2-yl)-methylamino]-N-propan-2-ylacetamide
CID 115978164
2-[[4-(dimethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]-methylamino]-N-propan-2-ylacetamide
CID 80901609
2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)-methylamino]-N-propan-2-ylacetamide
CID 80982333

Frequently Asked Questions

What is the IUPAC name of 2-[[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-methylamino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-methylamino]-N-propan-2-ylacetamide (CID 106959440) is 2-[[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-methylamino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-methylamino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-methylamino]-N-propan-2-ylacetamide is CC(C)NC(=O)CN(C)c1nnc(C(C)N)o1.
What is the InChIKey of 2-[[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-methylamino]-N-propan-2-ylacetamide?
The InChIKey is OCQLJOTWXFBLFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O2/c1-6(2)12-8(16)5-15(4)10-14-13-9(17-10)7(3)11/h6-7H,5,11H2,1-4H3,(H,12,16).
What are the key properties of 2-[[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-methylamino]-N-propan-2-ylacetamide?
2-[[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-methylamino]-N-propan-2-ylacetamide has a molecular weight of 241.29 g/mol, XLogP of 0.05, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-methylamino]-N-propan-2-ylacetamide is sourced from PubChem (CID 106959440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).