2-amino-N-[2-(1,2,4-oxadiazol-3-ylmethylamino)-2-oxoethyl]acetamide

C7H11N5O3 — CID 106396861

IUPAC2-amino-N-[2-(1,2,4-oxadiazol-3-ylmethylamino)-2-oxoethyl]acetamide
SMILESNCC(=O)NCC(=O)NCc1ncon1
InChIInChI=1S/C7H11N5O3/c8-1-6(13)10-3-7(14)9-2-5-11-4-15-12-5/h4H,1-3,8H2,(H,9,14)(H,10,13)
InChIKeyJKYDONHCZCJNGN-UHFFFAOYSA-N
MW213.20 g/mol
LogP-2.24
Rot. Bonds5

About 2-amino-N-[2-(1,2,4-oxadiazol-3-ylmethylamino)-2-oxoethyl]acetamide

2-amino-N-[2-(1,2,4-oxadiazol-3-ylmethylamino)-2-oxoethyl]acetamide (PubChem CID 106396861) has the molecular formula C7H11N5O3 and a molecular weight of 213.20 g/mol. Its IUPAC name is 2-amino-N-[2-(1,2,4-oxadiazol-3-ylmethylamino)-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-(1,2,4-oxadiazol-3-ylmethylamino)-2-oxoethyl]acetamide
PubChem CID106396861
Molecular FormulaC7H11N5O3
Molecular Weight213.20 g/mol
Exact Mass213.09
IUPAC Name2-amino-N-[2-(1,2,4-oxadiazol-3-ylmethylamino)-2-oxoethyl]acetamide
SMILESNCC(=O)NCC(=O)NCc1ncon1
InChIInChI=1S/C7H11N5O3/c8-1-6(13)10-3-7(14)9-2-5-11-4-15-12-5/h4H,1-3,8H2,(H,9,14)(H,10,13)
InChIKeyJKYDONHCZCJNGN-UHFFFAOYSA-N
XLogP-2.24
TPSA123.14 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.20
LogP ≤ 5-2.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(1,2,4-oxadiazol-3-ylmethylamino)-2-oxoethyl]acetamide?
The IUPAC name of 2-amino-N-[2-(1,2,4-oxadiazol-3-ylmethylamino)-2-oxoethyl]acetamide (CID 106396861) is 2-amino-N-[2-(1,2,4-oxadiazol-3-ylmethylamino)-2-oxoethyl]acetamide.
What is the SMILES notation for 2-amino-N-[2-(1,2,4-oxadiazol-3-ylmethylamino)-2-oxoethyl]acetamide?
The canonical SMILES for 2-amino-N-[2-(1,2,4-oxadiazol-3-ylmethylamino)-2-oxoethyl]acetamide is NCC(=O)NCC(=O)NCc1ncon1.
What is the InChIKey of 2-amino-N-[2-(1,2,4-oxadiazol-3-ylmethylamino)-2-oxoethyl]acetamide?
The InChIKey is JKYDONHCZCJNGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N5O3/c8-1-6(13)10-3-7(14)9-2-5-11-4-15-12-5/h4H,1-3,8H2,(H,9,14)(H,10,13).
What are the key properties of 2-amino-N-[2-(1,2,4-oxadiazol-3-ylmethylamino)-2-oxoethyl]acetamide?
2-amino-N-[2-(1,2,4-oxadiazol-3-ylmethylamino)-2-oxoethyl]acetamide has a molecular weight of 213.20 g/mol, XLogP of -2.24, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(1,2,4-oxadiazol-3-ylmethylamino)-2-oxoethyl]acetamide is sourced from PubChem (CID 106396861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).