2-[1-(methylamino)propan-2-yloxy]-N-prop-2-enylacetamide

C9H18N2O2 — CID 62338387

IUPAC2-[1-(methylamino)propan-2-yloxy]-N-prop-2-enylacetamide
SMILESC=CCNC(=O)COC(C)CNC
InChIInChI=1S/C9H18N2O2/c1-4-5-11-9(12)7-13-8(2)6-10-3/h4,8,10H,1,5-7H2,2-3H3,(H,11,12)
InChIKeyQPGBZCHWSDRETG-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.09
Rot. Bonds7

About 2-[1-(methylamino)propan-2-yloxy]-N-prop-2-enylacetamide

2-[1-(methylamino)propan-2-yloxy]-N-prop-2-enylacetamide (PubChem CID 62338387) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is 2-[1-(methylamino)propan-2-yloxy]-N-prop-2-enylacetamide.

Molecular Properties

Compound Name2-[1-(methylamino)propan-2-yloxy]-N-prop-2-enylacetamide
PubChem CID62338387
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name2-[1-(methylamino)propan-2-yloxy]-N-prop-2-enylacetamide
SMILESC=CCNC(=O)COC(C)CNC
InChIInChI=1S/C9H18N2O2/c1-4-5-11-9(12)7-13-8(2)6-10-3/h4,8,10H,1,5-7H2,2-3H3,(H,11,12)
InChIKeyQPGBZCHWSDRETG-UHFFFAOYSA-N
XLogP-0.09
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-[1-(methylamino)propan-2-yloxy]-N-prop-2-enylacetamide 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 2-[1-(methylamino)propan-2-yloxy]-N-prop-2-enylacetamide?
The IUPAC name of 2-[1-(methylamino)propan-2-yloxy]-N-prop-2-enylacetamide (CID 62338387) is 2-[1-(methylamino)propan-2-yloxy]-N-prop-2-enylacetamide.
What is the SMILES notation for 2-[1-(methylamino)propan-2-yloxy]-N-prop-2-enylacetamide?
The canonical SMILES for 2-[1-(methylamino)propan-2-yloxy]-N-prop-2-enylacetamide is C=CCNC(=O)COC(C)CNC.
What is the InChIKey of 2-[1-(methylamino)propan-2-yloxy]-N-prop-2-enylacetamide?
The InChIKey is QPGBZCHWSDRETG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-4-5-11-9(12)7-13-8(2)6-10-3/h4,8,10H,1,5-7H2,2-3H3,(H,11,12).
What are the key properties of 2-[1-(methylamino)propan-2-yloxy]-N-prop-2-enylacetamide?
2-[1-(methylamino)propan-2-yloxy]-N-prop-2-enylacetamide has a molecular weight of 186.25 g/mol, XLogP of -0.09, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(methylamino)propan-2-yloxy]-N-prop-2-enylacetamide is sourced from PubChem (CID 62338387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).