2-amino-N-[2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]-2-oxoethyl]acetamide

C8H13N5O3 — CID 106397273

IUPAC2-amino-N-[2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]-2-oxoethyl]acetamide
SMILESNCC(=O)NCC(=O)NCCc1ncno1
InChIInChI=1S/C8H13N5O3/c9-3-6(14)11-4-7(15)10-2-1-8-12-5-13-16-8/h5H,1-4,9H2,(H,10,15)(H,11,14)
InChIKeyUWHADBQXVPSMNQ-UHFFFAOYSA-N
MW227.22 g/mol
LogP-2.20
Rot. Bonds6

About 2-amino-N-[2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]-2-oxoethyl]acetamide

2-amino-N-[2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]-2-oxoethyl]acetamide (PubChem CID 106397273) has the molecular formula C8H13N5O3 and a molecular weight of 227.22 g/mol. Its IUPAC name is 2-amino-N-[2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]-2-oxoethyl]acetamide
PubChem CID106397273
Molecular FormulaC8H13N5O3
Molecular Weight227.22 g/mol
Exact Mass227.10
IUPAC Name2-amino-N-[2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]-2-oxoethyl]acetamide
SMILESNCC(=O)NCC(=O)NCCc1ncno1
InChIInChI=1S/C8H13N5O3/c9-3-6(14)11-4-7(15)10-2-1-8-12-5-13-16-8/h5H,1-4,9H2,(H,10,15)(H,11,14)
InChIKeyUWHADBQXVPSMNQ-UHFFFAOYSA-N
XLogP-2.20
TPSA123.14 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.22
LogP ≤ 5-2.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

3-[2-(1,2,4-oxadiazol-5-yl)ethylamino]-3-oxopropanoic acid
CID 104889379
3-amino-4-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]pentanamide
CID 106397303
2-(1-aminocyclobutyl)-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]acetamide
CID 106397532
1-methyl-3-[2-(1,2,4-oxadiazol-5-yl)ethyl]urea
CID 103743952
2-amino-N-[2-oxo-2-[2-(1H-1,2,4-triazol-5-yl)ethylamino]ethyl]acetamide
CID 64532139
4-amino-2-methyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]butanamide
CID 106397296
3-amino-5,5-dimethyl-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]hexanamide
CID 114183576
(2R)-2-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]butanamide
CID 106397573
3-(3-aminophenyl)-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]propanamide
CID 106391534
2-amino-N-[2-[2-(furan-2-yl)ethylamino]-2-oxoethyl]acetamide
CID 60847606
3-amino-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]-2-phenylpropanamide
CID 106397456
2-[1-[2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]-2-oxoethyl]cyclopentyl]acetic acid
CID 106394652

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]-2-oxoethyl]acetamide?
The IUPAC name of 2-amino-N-[2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]-2-oxoethyl]acetamide (CID 106397273) is 2-amino-N-[2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]-2-oxoethyl]acetamide.
What is the SMILES notation for 2-amino-N-[2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]-2-oxoethyl]acetamide?
The canonical SMILES for 2-amino-N-[2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]-2-oxoethyl]acetamide is NCC(=O)NCC(=O)NCCc1ncno1.
What is the InChIKey of 2-amino-N-[2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]-2-oxoethyl]acetamide?
The InChIKey is UWHADBQXVPSMNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N5O3/c9-3-6(14)11-4-7(15)10-2-1-8-12-5-13-16-8/h5H,1-4,9H2,(H,10,15)(H,11,14).
What are the key properties of 2-amino-N-[2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]-2-oxoethyl]acetamide?
2-amino-N-[2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]-2-oxoethyl]acetamide has a molecular weight of 227.22 g/mol, XLogP of -2.20, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]-2-oxoethyl]acetamide is sourced from PubChem (CID 106397273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).