3-methoxy-2-methyl-N-[(Z)-2-methylidenepent-3-enyl]propanamide

C11H19NO2 — CID 90131911

IUPAC3-methoxy-2-methyl-N-[(Z)-2-methylidenepent-3-enyl]propanamide
SMILESC=C(/C=C\C)CNC(=O)C(C)COC
InChIInChI=1S/C11H19NO2/c1-5-6-9(2)7-12-11(13)10(3)8-14-4/h5-6,10H,2,7-8H2,1,3-4H3,(H,12,13)/b6-5-
InChIKeyRHAPTKHGJAUGTE-WAYWQWQTSA-N
MW197.28 g/mol
LogP1.52
Rot. Bonds6

About 3-methoxy-2-methyl-N-[(Z)-2-methylidenepent-3-enyl]propanamide

3-methoxy-2-methyl-N-[(Z)-2-methylidenepent-3-enyl]propanamide (PubChem CID 90131911) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 3-methoxy-2-methyl-N-[(Z)-2-methylidenepent-3-enyl]propanamide.

Molecular Properties

Compound Name3-methoxy-2-methyl-N-[(Z)-2-methylidenepent-3-enyl]propanamide
PubChem CID90131911
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name3-methoxy-2-methyl-N-[(Z)-2-methylidenepent-3-enyl]propanamide
SMILESC=C(/C=C\C)CNC(=O)C(C)COC
InChIInChI=1S/C11H19NO2/c1-5-6-9(2)7-12-11(13)10(3)8-14-4/h5-6,10H,2,7-8H2,1,3-4H3,(H,12,13)/b6-5-
InChIKeyRHAPTKHGJAUGTE-WAYWQWQTSA-N
XLogP1.52
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-methyl-N-[(Z)-2-methylidenepent-3-enyl]propanamide?
The IUPAC name of 3-methoxy-2-methyl-N-[(Z)-2-methylidenepent-3-enyl]propanamide (CID 90131911) is 3-methoxy-2-methyl-N-[(Z)-2-methylidenepent-3-enyl]propanamide.
What is the SMILES notation for 3-methoxy-2-methyl-N-[(Z)-2-methylidenepent-3-enyl]propanamide?
The canonical SMILES for 3-methoxy-2-methyl-N-[(Z)-2-methylidenepent-3-enyl]propanamide is C=C(/C=C\C)CNC(=O)C(C)COC.
What is the InChIKey of 3-methoxy-2-methyl-N-[(Z)-2-methylidenepent-3-enyl]propanamide?
The InChIKey is RHAPTKHGJAUGTE-WAYWQWQTSA-N. The full InChI is InChI=1S/C11H19NO2/c1-5-6-9(2)7-12-11(13)10(3)8-14-4/h5-6,10H,2,7-8H2,1,3-4H3,(H,12,13)/b6-5-.
What are the key properties of 3-methoxy-2-methyl-N-[(Z)-2-methylidenepent-3-enyl]propanamide?
3-methoxy-2-methyl-N-[(Z)-2-methylidenepent-3-enyl]propanamide has a molecular weight of 197.28 g/mol, XLogP of 1.52, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-methyl-N-[(Z)-2-methylidenepent-3-enyl]propanamide is sourced from PubChem (CID 90131911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).