2-amino-N-(2-oxobut-3-enyl)acetamide

C6H10N2O2 — CID 142697377

IUPAC2-amino-N-(2-oxobut-3-enyl)acetamide
SMILESC=CC(=O)CNC(=O)CN
InChIInChI=1S/C6H10N2O2/c1-2-5(9)4-8-6(10)3-7/h2H,1,3-4,7H2,(H,8,10)
InChIKeyCGDRHAXDOJICQC-UHFFFAOYSA-N
MW142.16 g/mol
LogP-1.18
Rot. Bonds4

About 2-amino-N-(2-oxobut-3-enyl)acetamide

2-amino-N-(2-oxobut-3-enyl)acetamide (PubChem CID 142697377) has the molecular formula C6H10N2O2 and a molecular weight of 142.16 g/mol. Its IUPAC name is 2-amino-N-(2-oxobut-3-enyl)acetamide.

Molecular Properties

Compound Name2-amino-N-(2-oxobut-3-enyl)acetamide
PubChem CID142697377
Molecular FormulaC6H10N2O2
Molecular Weight142.16 g/mol
Exact Mass142.07
IUPAC Name2-amino-N-(2-oxobut-3-enyl)acetamide
SMILESC=CC(=O)CNC(=O)CN
InChIInChI=1S/C6H10N2O2/c1-2-5(9)4-8-6(10)3-7/h2H,1,3-4,7H2,(H,8,10)
InChIKeyCGDRHAXDOJICQC-UHFFFAOYSA-N
XLogP-1.18
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-1.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-[2-[[2-[[2-[[2-[[2-(2-methylprop-2-enylamino)-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]acetamide
CID 121440614
2-[(2-aminoacetyl)amino]acetic acid;iron
CID 88519738
2-amino-N-[2-oxo-2-(2-oxopropylamino)ethyl]acetamide;(3Z)-3-methylhexa-1,3,5-triene
CID 168969104
N-(hydroxymethyl)-3-oxopent-4-enamide
CID 20517920
azanium 2-[(2-aminoacetyl)amino]acetate
CID 172849097
2-amino-N-[2-oxo-2-[[2-oxo-2-[[2-oxo-2-[[2-oxo-2-[[2-oxo-2-[[2-oxo-2-[[2-oxo-2-(2-oxoethylamino)ethyl]amino]ethyl]amino]ethyl]amino]ethyl]amino]ethyl]amino]ethyl]amino]ethyl]acetamide
CID 122707091
2-aminoacetic acid;N-(2-aminoacetyl)prop-2-enamide
CID 175562019
2-amino-N-[(3E,12Z)-2-oxononadeca-3,12-dienyl]acetamide
CID 144912619
2-amino-N-[2-(4-ethenylanilino)-2-oxoethyl]acetamide
CID 143732888
methyl 2-[(2-aminoacetyl)amino]acetate;hydrochloride
CID 13029724
2-amino-N-[2-[2-(carbamoylamino)ethylamino]-2-oxoethyl]acetamide
CID 83111303
2-amino-N-(5-amino-2-oxopentyl)acetamide
CID 141063651

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-oxobut-3-enyl)acetamide?
The IUPAC name of 2-amino-N-(2-oxobut-3-enyl)acetamide (CID 142697377) is 2-amino-N-(2-oxobut-3-enyl)acetamide.
What is the SMILES notation for 2-amino-N-(2-oxobut-3-enyl)acetamide?
The canonical SMILES for 2-amino-N-(2-oxobut-3-enyl)acetamide is C=CC(=O)CNC(=O)CN.
What is the InChIKey of 2-amino-N-(2-oxobut-3-enyl)acetamide?
The InChIKey is CGDRHAXDOJICQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O2/c1-2-5(9)4-8-6(10)3-7/h2H,1,3-4,7H2,(H,8,10).
What are the key properties of 2-amino-N-(2-oxobut-3-enyl)acetamide?
2-amino-N-(2-oxobut-3-enyl)acetamide has a molecular weight of 142.16 g/mol, XLogP of -1.18, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-oxobut-3-enyl)acetamide is sourced from PubChem (CID 142697377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).