2-(2-methylimidazolidin-1-yl)-N-[(E)-pent-2-enyl]acetamide

C11H21N3O — CID 178011261

IUPAC2-(2-methylimidazolidin-1-yl)-N-[(E)-pent-2-enyl]acetamide
SMILESCC/C=C/CNC(=O)CN1CCNC1C
InChIInChI=1S/C11H21N3O/c1-3-4-5-6-13-11(15)9-14-8-7-12-10(14)2/h4-5,10,12H,3,6-9H2,1-2H3,(H,13,15)/b5-4+
InChIKeyRRWOKYFUPPVADG-SNAWJCMRSA-N
MW211.31 g/mol
LogP0.32
Rot. Bonds5

About 2-(2-methylimidazolidin-1-yl)-N-[(E)-pent-2-enyl]acetamide

2-(2-methylimidazolidin-1-yl)-N-[(E)-pent-2-enyl]acetamide (PubChem CID 178011261) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 2-(2-methylimidazolidin-1-yl)-N-[(E)-pent-2-enyl]acetamide.

Molecular Properties

Compound Name2-(2-methylimidazolidin-1-yl)-N-[(E)-pent-2-enyl]acetamide
PubChem CID178011261
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name2-(2-methylimidazolidin-1-yl)-N-[(E)-pent-2-enyl]acetamide
SMILESCC/C=C/CNC(=O)CN1CCNC1C
InChIInChI=1S/C11H21N3O/c1-3-4-5-6-13-11(15)9-14-8-7-12-10(14)2/h4-5,10,12H,3,6-9H2,1-2H3,(H,13,15)/b5-4+
InChIKeyRRWOKYFUPPVADG-SNAWJCMRSA-N
XLogP0.32
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-(2-methylimidazolidin-1-yl)-N-[(E)-pent-2-enyl]acetamide?
The IUPAC name of 2-(2-methylimidazolidin-1-yl)-N-[(E)-pent-2-enyl]acetamide (CID 178011261) is 2-(2-methylimidazolidin-1-yl)-N-[(E)-pent-2-enyl]acetamide.
What is the SMILES notation for 2-(2-methylimidazolidin-1-yl)-N-[(E)-pent-2-enyl]acetamide?
The canonical SMILES for 2-(2-methylimidazolidin-1-yl)-N-[(E)-pent-2-enyl]acetamide is CC/C=C/CNC(=O)CN1CCNC1C.
What is the InChIKey of 2-(2-methylimidazolidin-1-yl)-N-[(E)-pent-2-enyl]acetamide?
The InChIKey is RRWOKYFUPPVADG-SNAWJCMRSA-N. The full InChI is InChI=1S/C11H21N3O/c1-3-4-5-6-13-11(15)9-14-8-7-12-10(14)2/h4-5,10,12H,3,6-9H2,1-2H3,(H,13,15)/b5-4+.
What are the key properties of 2-(2-methylimidazolidin-1-yl)-N-[(E)-pent-2-enyl]acetamide?
2-(2-methylimidazolidin-1-yl)-N-[(E)-pent-2-enyl]acetamide has a molecular weight of 211.31 g/mol, XLogP of 0.32, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylimidazolidin-1-yl)-N-[(E)-pent-2-enyl]acetamide is sourced from PubChem (CID 178011261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).