2-aminoprop-2-enamide

C3H6N2O — CID 3332061

IUPAC2-aminoprop-2-enamide
SMILESC=C(N)C(N)=O
InChIInChI=1S/C3H6N2O/c1-2(4)3(5)6/h1,4H2,(H2,5,6)
InChIKeyIUMRWGYGZHKZKF-UHFFFAOYSA-N
MW86.09 g/mol
LogP-1.06
Rot. Bonds1

About 2-aminoprop-2-enamide

2-aminoprop-2-enamide (PubChem CID 3332061) has the molecular formula C3H6N2O and a molecular weight of 86.09 g/mol. Its IUPAC name is 2-aminoprop-2-enamide.

Molecular Properties

Compound Name2-aminoprop-2-enamide
PubChem CID3332061
Molecular FormulaC3H6N2O
Molecular Weight86.09 g/mol
Exact Mass86.05
IUPAC Name2-aminoprop-2-enamide
SMILESC=C(N)C(N)=O
InChIInChI=1S/C3H6N2O/c1-2(4)3(5)6/h1,4H2,(H2,5,6)
InChIKeyIUMRWGYGZHKZKF-UHFFFAOYSA-N
XLogP-1.06
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50086.09
LogP ≤ 5-1.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-aminoprop-2-enamide;prop-2-enoic acid
CID 173105989
2-aminoprop-2-enamide;aniline
CID 143815289
2-methylprop-2-enamide;hydrate
CID 88749193
ethene-1,1-diol;prop-2-enamide
CID 174658864
2-(aminomethyl)prop-2-enamide
CID 19089601
1,1-dichloroethene;urea
CID 174817007
3-carbamoyl-2-methylidenebut-3-enoic acid
CID 71342236
N-methylmethanamine;2-methylprop-2-enamide
CID 87110078
diamino(113C)methanone
CID 636363
CID 118976628
CID 118976628
prop-2-enamide iodide
CID 19796963
prop-2-enamide;ruthenium
CID 90254548

Frequently Asked Questions

What is the IUPAC name of 2-aminoprop-2-enamide?
The IUPAC name of 2-aminoprop-2-enamide (CID 3332061) is 2-aminoprop-2-enamide.
What is the SMILES notation for 2-aminoprop-2-enamide?
The canonical SMILES for 2-aminoprop-2-enamide is C=C(N)C(N)=O.
What is the InChIKey of 2-aminoprop-2-enamide?
The InChIKey is IUMRWGYGZHKZKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6N2O/c1-2(4)3(5)6/h1,4H2,(H2,5,6).
What are the key properties of 2-aminoprop-2-enamide?
2-aminoprop-2-enamide has a molecular weight of 86.09 g/mol, XLogP of -1.06, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoprop-2-enamide is sourced from PubChem (CID 3332061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).