N-prop-2-enyl-2-(prop-2-enylamino)acetamide

C8H14N2O — CID 54818259

IUPACN-prop-2-enyl-2-(prop-2-enylamino)acetamide
SMILESC=CCNCC(=O)NCC=C
InChIInChI=1S/C8H14N2O/c1-3-5-9-7-8(11)10-6-4-2/h3-4,9H,1-2,5-7H2,(H,10,11)
InChIKeyHBGWDSUCIXNXKZ-UHFFFAOYSA-N
MW154.21 g/mol
LogP0.06
Rot. Bonds6

About N-prop-2-enyl-2-(prop-2-enylamino)acetamide

N-prop-2-enyl-2-(prop-2-enylamino)acetamide (PubChem CID 54818259) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is N-prop-2-enyl-2-(prop-2-enylamino)acetamide.

Molecular Properties

Compound NameN-prop-2-enyl-2-(prop-2-enylamino)acetamide
PubChem CID54818259
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC NameN-prop-2-enyl-2-(prop-2-enylamino)acetamide
SMILESC=CCNCC(=O)NCC=C
InChIInChI=1S/C8H14N2O/c1-3-5-9-7-8(11)10-6-4-2/h3-4,9H,1-2,5-7H2,(H,10,11)
InChIKeyHBGWDSUCIXNXKZ-UHFFFAOYSA-N
XLogP0.06
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-prop-2-enyl-2-(prop-2-enylamino)acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-prop-2-enyl-2-(prop-2-enylamino)acetamide?
The IUPAC name of N-prop-2-enyl-2-(prop-2-enylamino)acetamide (CID 54818259) is N-prop-2-enyl-2-(prop-2-enylamino)acetamide.
What is the SMILES notation for N-prop-2-enyl-2-(prop-2-enylamino)acetamide?
The canonical SMILES for N-prop-2-enyl-2-(prop-2-enylamino)acetamide is C=CCNCC(=O)NCC=C.
What is the InChIKey of N-prop-2-enyl-2-(prop-2-enylamino)acetamide?
The InChIKey is HBGWDSUCIXNXKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-3-5-9-7-8(11)10-6-4-2/h3-4,9H,1-2,5-7H2,(H,10,11).
What are the key properties of N-prop-2-enyl-2-(prop-2-enylamino)acetamide?
N-prop-2-enyl-2-(prop-2-enylamino)acetamide has a molecular weight of 154.21 g/mol, XLogP of 0.06, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-prop-2-enyl-2-(prop-2-enylamino)acetamide is sourced from PubChem (CID 54818259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).