potassium 2-(prop-2-enylamino)acetate

C5H8KNO2 — CID 23664258

IUPACpotassium 2-(prop-2-enylamino)acetate
SMILESC=CCNCC(=O)[O-].[K+]
InChIInChI=1S/C5H9NO2.K/c1-2-3-6-4-5(7)8;/h2,6H,1,3-4H2,(H,7,8);/q;+1/p-1
InChIKeyVASRYMCNIOVIDH-UHFFFAOYSA-M
MW153.22 g/mol
LogP-4.48
Rot. Bonds4

About potassium 2-(prop-2-enylamino)acetate

potassium 2-(prop-2-enylamino)acetate (PubChem CID 23664258) has the molecular formula C5H8KNO2 and a molecular weight of 153.22 g/mol. Its IUPAC name is potassium 2-(prop-2-enylamino)acetate.

Molecular Properties

Compound Namepotassium 2-(prop-2-enylamino)acetate
PubChem CID23664258
Molecular FormulaC5H8KNO2
Molecular Weight153.22 g/mol
Exact Mass153.02
IUPAC Namepotassium 2-(prop-2-enylamino)acetate
SMILESC=CCNCC(=O)[O-].[K+]
InChIInChI=1S/C5H9NO2.K/c1-2-3-6-4-5(7)8;/h2,6H,1,3-4H2,(H,7,8);/q;+1/p-1
InChIKeyVASRYMCNIOVIDH-UHFFFAOYSA-M
XLogP-4.48
TPSA52.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 5-4.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze potassium 2-(prop-2-enylamino)acetate 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

N-Allylglycine
CID 76651
CID 36690796
CID 36690796
N-2-Propen-1-ylglycine ethyl ester
CID 10975597
Methyl 2-[(prop-2-en-1-yl)amino]acetate
CID 13454969
2-[(But-3-en-1-yl)amino]acetic acid
CID 18506529
Diallylammonioethanoate
CID 42232764
N-But-2-en-1-ylglycine
CID 53407996
cis-Crotylglycine
CID 87168838
2-(1,3-Difluoroprop-2-enylamino)acetic acid
CID 175555566
Allylglycin-hydrobromid
CID 129648695
N-(ethynyl)allylglycine
CID 129652775
Carboxymethyl(prop-2-enyl)azanium
CID 134844890

Frequently Asked Questions

What is the IUPAC name of potassium 2-(prop-2-enylamino)acetate?
The IUPAC name of potassium 2-(prop-2-enylamino)acetate (CID 23664258) is potassium 2-(prop-2-enylamino)acetate.
What is the SMILES notation for potassium 2-(prop-2-enylamino)acetate?
The canonical SMILES for potassium 2-(prop-2-enylamino)acetate is C=CCNCC(=O)[O-].[K+].
What is the InChIKey of potassium 2-(prop-2-enylamino)acetate?
The InChIKey is VASRYMCNIOVIDH-UHFFFAOYSA-M. The full InChI is InChI=1S/C5H9NO2.K/c1-2-3-6-4-5(7)8;/h2,6H,1,3-4H2,(H,7,8);/q;+1/p-1.
What are the key properties of potassium 2-(prop-2-enylamino)acetate?
potassium 2-(prop-2-enylamino)acetate has a molecular weight of 153.22 g/mol, XLogP of -4.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 2-(prop-2-enylamino)acetate is sourced from PubChem (CID 23664258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).