2-aminopent-4-enamide

C5H10N2O — CID 10034618

IUPAC2-aminopent-4-enamide
SMILESC=CCC(N)C(N)=O
InChIInChI=1S/C5H10N2O/c1-2-3-4(6)5(7)8/h2,4H,1,3,6H2,(H2,7,8)
InChIKeyMHCFJYPAEKWGBR-UHFFFAOYSA-N
MW114.15 g/mol
LogP-0.62
Rot. Bonds3

About 2-aminopent-4-enamide

2-aminopent-4-enamide (PubChem CID 10034618) has the molecular formula C5H10N2O and a molecular weight of 114.15 g/mol. Its IUPAC name is 2-aminopent-4-enamide.

Molecular Properties

Compound Name2-aminopent-4-enamide
PubChem CID10034618
Molecular FormulaC5H10N2O
Molecular Weight114.15 g/mol
Exact Mass114.08
IUPAC Name2-aminopent-4-enamide
SMILESC=CCC(N)C(N)=O
InChIInChI=1S/C5H10N2O/c1-2-3-4(6)5(7)8/h2,4H,1,3,6H2,(H2,7,8)
InChIKeyMHCFJYPAEKWGBR-UHFFFAOYSA-N
XLogP-0.62
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.15
LogP ≤ 5-0.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-aminopent-4-enamide?
The IUPAC name of 2-aminopent-4-enamide (CID 10034618) is 2-aminopent-4-enamide.
What is the SMILES notation for 2-aminopent-4-enamide?
The canonical SMILES for 2-aminopent-4-enamide is C=CCC(N)C(N)=O.
What is the InChIKey of 2-aminopent-4-enamide?
The InChIKey is MHCFJYPAEKWGBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O/c1-2-3-4(6)5(7)8/h2,4H,1,3,6H2,(H2,7,8).
What are the key properties of 2-aminopent-4-enamide?
2-aminopent-4-enamide has a molecular weight of 114.15 g/mol, XLogP of -0.62, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminopent-4-enamide is sourced from PubChem (CID 10034618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).