N-[(Z)-prop-1-enyl]propan-2-imine

C6H11N — CID 54364346

About N-[(Z)-prop-1-enyl]propan-2-imine

N-[(Z)-prop-1-enyl]propan-2-imine (PubChem CID 54364346) has the molecular formula C6H11N and a molecular weight of 97.16 g/mol. Its IUPAC name is N-[(Z)-prop-1-enyl]propan-2-imine.

Molecular Properties

• Compound Name: N-[(Z)-prop-1-enyl]propan-2-imine
• PubChem CID: 54364346
• Molecular Formula: C6H11N
• Molecular Weight: 97.16 g/mol
• Exact Mass: 97.09
• IUPAC Name: N-[(Z)-prop-1-enyl]propan-2-imine
• SMILES: C/C=C\N=C(C)C
• InChI: InChI=1S/C6H11N/c1-4-5-7-6(2)3/h4-5H,1-3H3/b5-4-
• InChIKey: UOSRPRKMNSUNQQ-PLNGDYQASA-N
• XLogP: 2.00
• TPSA: 12.36 Ų
• H-Bond Acceptors: 1
• Rotatable Bonds: 1
• Heavy Atoms: 7
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	97.16
LogP ≤ 5	2.00
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-prop-1-enyl]propan-2-imine?

The IUPAC name of N-[(Z)-prop-1-enyl]propan-2-imine (CID 54364346) is N-[(Z)-prop-1-enyl]propan-2-imine.

What is the SMILES notation for N-[(Z)-prop-1-enyl]propan-2-imine?

The canonical SMILES for N-[(Z)-prop-1-enyl]propan-2-imine is C/C=C\N=C(C)C.

What is the InChIKey of N-[(Z)-prop-1-enyl]propan-2-imine?

The InChIKey is UOSRPRKMNSUNQQ-PLNGDYQASA-N. The full InChI is InChI=1S/C6H11N/c1-4-5-7-6(2)3/h4-5H,1-3H3/b5-4-.

What are the key properties of N-[(Z)-prop-1-enyl]propan-2-imine?

N-[(Z)-prop-1-enyl]propan-2-imine has a molecular weight of 97.16 g/mol, XLogP of 2.00, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(Z)-prop-1-enyl]propan-2-imine is sourced from PubChem (CID 54364346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).