2-amino-N-[2-oxo-2-(prop-2-enylamino)ethyl]acetamide

C7H13N3O2 — CID 60848455

IUPAC2-amino-N-[2-oxo-2-(prop-2-enylamino)ethyl]acetamide
SMILESC=CCNC(=O)CNC(=O)CN
InChIInChI=1S/C7H13N3O2/c1-2-3-9-7(12)5-10-6(11)4-8/h2H,1,3-5,8H2,(H,9,12)(H,10,11)
InChIKeyRUEJXPYCCHKVRB-UHFFFAOYSA-N
MW171.20 g/mol
LogP-1.64
Rot. Bonds5

About 2-amino-N-[2-oxo-2-(prop-2-enylamino)ethyl]acetamide

2-amino-N-[2-oxo-2-(prop-2-enylamino)ethyl]acetamide (PubChem CID 60848455) has the molecular formula C7H13N3O2 and a molecular weight of 171.20 g/mol. Its IUPAC name is 2-amino-N-[2-oxo-2-(prop-2-enylamino)ethyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-oxo-2-(prop-2-enylamino)ethyl]acetamide
PubChem CID60848455
Molecular FormulaC7H13N3O2
Molecular Weight171.20 g/mol
Exact Mass171.10
IUPAC Name2-amino-N-[2-oxo-2-(prop-2-enylamino)ethyl]acetamide
SMILESC=CCNC(=O)CNC(=O)CN
InChIInChI=1S/C7H13N3O2/c1-2-3-9-7(12)5-10-6(11)4-8/h2H,1,3-5,8H2,(H,9,12)(H,10,11)
InChIKeyRUEJXPYCCHKVRB-UHFFFAOYSA-N
XLogP-1.64
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.20
LogP ≤ 5-1.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-amino-N-[2-oxo-2-(prop-2-enylamino)ethyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-Propenamide, N,N'-1,2-ethanediylbis-
CID 168964
N~1~,N~2~-diallylethanediamide
CID 241033
N-(2-Amino-2-oxoethyl)acrylamide
CID 20038864
2-(piperazin-1-yl)-N-(prop-2-en-1-yl)acetamide
CID 8893273
2-amino-N-(prop-2-en-1-yl)acetamide hydrochloride
CID 53410800
N-(2-aminoethyl)acrylamide
CID 152664
2-amino-N-(prop-2-en-1-yl)acetamide
CID 18446443
N~2~-Prop-2-en-1-ylglycinamide
CID 18474081
Allyloxamid
CID 22736542
N-acryloyl diethylenetriamine
CID 23526136
N-methyl-2-[(prop-2-en-1-yl)amino]acetamide
CID 28563374
Tetrahydro-2h-1,4-diazepin-2-one
CID 53959536

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-oxo-2-(prop-2-enylamino)ethyl]acetamide?
The IUPAC name of 2-amino-N-[2-oxo-2-(prop-2-enylamino)ethyl]acetamide (CID 60848455) is 2-amino-N-[2-oxo-2-(prop-2-enylamino)ethyl]acetamide.
What is the SMILES notation for 2-amino-N-[2-oxo-2-(prop-2-enylamino)ethyl]acetamide?
The canonical SMILES for 2-amino-N-[2-oxo-2-(prop-2-enylamino)ethyl]acetamide is C=CCNC(=O)CNC(=O)CN.
What is the InChIKey of 2-amino-N-[2-oxo-2-(prop-2-enylamino)ethyl]acetamide?
The InChIKey is RUEJXPYCCHKVRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O2/c1-2-3-9-7(12)5-10-6(11)4-8/h2H,1,3-5,8H2,(H,9,12)(H,10,11).
What are the key properties of 2-amino-N-[2-oxo-2-(prop-2-enylamino)ethyl]acetamide?
2-amino-N-[2-oxo-2-(prop-2-enylamino)ethyl]acetamide has a molecular weight of 171.20 g/mol, XLogP of -1.64, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-oxo-2-(prop-2-enylamino)ethyl]acetamide is sourced from PubChem (CID 60848455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).