2-methoxy-2-methyl-N-prop-2-enyl-N-propylpropanamide

C11H21NO2 — CID 103029248

IUPAC2-methoxy-2-methyl-N-prop-2-enyl-N-propylpropanamide
SMILESC=CCN(CCC)C(=O)C(C)(C)OC
InChIInChI=1S/C11H21NO2/c1-6-8-12(9-7-2)10(13)11(3,4)14-5/h6H,1,7-9H2,2-5H3
InChIKeyIDDSPLRKVJYBQY-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.84
Rot. Bonds6

About 2-methoxy-2-methyl-N-prop-2-enyl-N-propylpropanamide

2-methoxy-2-methyl-N-prop-2-enyl-N-propylpropanamide (PubChem CID 103029248) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 2-methoxy-2-methyl-N-prop-2-enyl-N-propylpropanamide.

Molecular Properties

Compound Name2-methoxy-2-methyl-N-prop-2-enyl-N-propylpropanamide
PubChem CID103029248
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name2-methoxy-2-methyl-N-prop-2-enyl-N-propylpropanamide
SMILESC=CCN(CCC)C(=O)C(C)(C)OC
InChIInChI=1S/C11H21NO2/c1-6-8-12(9-7-2)10(13)11(3,4)14-5/h6H,1,7-9H2,2-5H3
InChIKeyIDDSPLRKVJYBQY-UHFFFAOYSA-N
XLogP1.84
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.84
H-Bond Donors ≤ 50
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-methoxy-2-methyl-N-prop-2-enyl-N-propylpropanamide?
The IUPAC name of 2-methoxy-2-methyl-N-prop-2-enyl-N-propylpropanamide (CID 103029248) is 2-methoxy-2-methyl-N-prop-2-enyl-N-propylpropanamide.
What is the SMILES notation for 2-methoxy-2-methyl-N-prop-2-enyl-N-propylpropanamide?
The canonical SMILES for 2-methoxy-2-methyl-N-prop-2-enyl-N-propylpropanamide is C=CCN(CCC)C(=O)C(C)(C)OC.
What is the InChIKey of 2-methoxy-2-methyl-N-prop-2-enyl-N-propylpropanamide?
The InChIKey is IDDSPLRKVJYBQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-6-8-12(9-7-2)10(13)11(3,4)14-5/h6H,1,7-9H2,2-5H3.
What are the key properties of 2-methoxy-2-methyl-N-prop-2-enyl-N-propylpropanamide?
2-methoxy-2-methyl-N-prop-2-enyl-N-propylpropanamide has a molecular weight of 199.29 g/mol, XLogP of 1.84, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2-methyl-N-prop-2-enyl-N-propylpropanamide is sourced from PubChem (CID 103029248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).