(Z)-3-aminoprop-2-enamide

C3H6N2O — CID 59960675

IUPAC(Z)-3-aminoprop-2-enamide
SMILESN/C=C\C(N)=O
InChIInChI=1S/C3H6N2O/c4-2-1-3(5)6/h1-2H,4H2,(H2,5,6)/b2-1-
InChIKeyQHAKAGPSCONBON-UPHRSURJSA-N
MW86.09 g/mol
LogP-1.06
Rot. Bonds1

About (Z)-3-aminoprop-2-enamide

(Z)-3-aminoprop-2-enamide (PubChem CID 59960675) has the molecular formula C3H6N2O and a molecular weight of 86.09 g/mol. Its IUPAC name is (Z)-3-aminoprop-2-enamide.

Molecular Properties

Compound Name(Z)-3-aminoprop-2-enamide
PubChem CID59960675
Molecular FormulaC3H6N2O
Molecular Weight86.09 g/mol
Exact Mass86.05
IUPAC Name(Z)-3-aminoprop-2-enamide
SMILESN/C=C\C(N)=O
InChIInChI=1S/C3H6N2O/c4-2-1-3(5)6/h1-2H,4H2,(H2,5,6)/b2-1-
InChIKeyQHAKAGPSCONBON-UPHRSURJSA-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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Frequently Asked Questions

What is the IUPAC name of (Z)-3-aminoprop-2-enamide?
The IUPAC name of (Z)-3-aminoprop-2-enamide (CID 59960675) is (Z)-3-aminoprop-2-enamide.
What is the SMILES notation for (Z)-3-aminoprop-2-enamide?
The canonical SMILES for (Z)-3-aminoprop-2-enamide is N/C=C\C(N)=O.
What is the InChIKey of (Z)-3-aminoprop-2-enamide?
The InChIKey is QHAKAGPSCONBON-UPHRSURJSA-N. The full InChI is InChI=1S/C3H6N2O/c4-2-1-3(5)6/h1-2H,4H2,(H2,5,6)/b2-1-.
What are the key properties of (Z)-3-aminoprop-2-enamide?
(Z)-3-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 (Z)-3-aminoprop-2-enamide is sourced from PubChem (CID 59960675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).