2-(2-methoxyphenoxy)-N-[(Z)-[(3S)-3-methylpentan-2-ylidene]amino]acetamide

C15H22N2O3 — CID 9315778

IUPAC2-(2-methoxyphenoxy)-N-[(Z)-[(3S)-3-methylpentan-2-ylidene]amino]acetamide
SMILESCC[C@H](C)/C(C)=N\NC(=O)COc1ccccc1OC
InChIInChI=1S/C15H22N2O3/c1-5-11(2)12(3)16-17-15(18)10-20-14-9-7-6-8-13(14)19-4/h6-9,11H,5,10H2,1-4H3,(H,17,18)/b16-12-/t11-/m0/s1
InChIKeyPRXNNRZQEQFDQJ-SPSOFYIISA-N
MW278.35 g/mol
LogP2.61
Rot. Bonds7

About 2-(2-methoxyphenoxy)-N-[(Z)-[(3S)-3-methylpentan-2-ylidene]amino]acetamide

2-(2-methoxyphenoxy)-N-[(Z)-[(3S)-3-methylpentan-2-ylidene]amino]acetamide (PubChem CID 9315778) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 2-(2-methoxyphenoxy)-N-[(Z)-[(3S)-3-methylpentan-2-ylidene]amino]acetamide.

Molecular Properties

Compound Name2-(2-methoxyphenoxy)-N-[(Z)-[(3S)-3-methylpentan-2-ylidene]amino]acetamide
PubChem CID9315778
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name2-(2-methoxyphenoxy)-N-[(Z)-[(3S)-3-methylpentan-2-ylidene]amino]acetamide
SMILESCC[C@H](C)/C(C)=N\NC(=O)COc1ccccc1OC
InChIInChI=1S/C15H22N2O3/c1-5-11(2)12(3)16-17-15(18)10-20-14-9-7-6-8-13(14)19-4/h6-9,11H,5,10H2,1-4H3,(H,17,18)/b16-12-/t11-/m0/s1
InChIKeyPRXNNRZQEQFDQJ-SPSOFYIISA-N
XLogP2.61
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(2-methoxyphenoxy)-N-(3-methylbutan-2-ylideneamino)acetamide
CID 4560808
2-(2,5-dimethylphenoxy)-N-[(Z)-[(3R)-3-methylpentan-2-ylidene]amino]acetamide
CID 9316036
3-[[2-(2-methoxyphenoxy)acetyl]hydrazinylidene]-N-(2-methylpropyl)butanamide
CID 3829481
N-[1-(furan-2-yl)ethylideneamino]-2-(2-methoxyphenoxy)acetamide
CID 922218
2-(2-butan-2-ylphenoxy)-N-[(E)-1,1-diphenylpropan-2-ylideneamino]acetamide
CID 54785277
2-(2-methoxyphenoxy)-N-pentan-2-ylacetamide
CID 2957379
N-(2-ethylbutyl)-2-(2-methoxyphenoxy)acetamide
CID 115612569
methyl (2R)-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanoate
CID 113257879
N-[(Z)-1-(2,5-dimethylthiophen-3-yl)ethylideneamino]-2-(2-methoxyphenoxy)acetamide
CID 9315700
N-[(Z)-1-(2,5-difluorophenyl)ethylideneamino]-2-(2-methoxyphenoxy)acetamide
CID 9315771
N-[(Z)-1-(3-aminophenyl)ethylideneamino]-2-(2-methoxyphenoxy)acetamide
CID 5419932
N-[1-(3,4-dichlorophenyl)propylideneamino]-2-(2-methoxyphenoxy)acetamide
CID 4845784

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenoxy)-N-[(Z)-[(3S)-3-methylpentan-2-ylidene]amino]acetamide?
The IUPAC name of 2-(2-methoxyphenoxy)-N-[(Z)-[(3S)-3-methylpentan-2-ylidene]amino]acetamide (CID 9315778) is 2-(2-methoxyphenoxy)-N-[(Z)-[(3S)-3-methylpentan-2-ylidene]amino]acetamide.
What is the SMILES notation for 2-(2-methoxyphenoxy)-N-[(Z)-[(3S)-3-methylpentan-2-ylidene]amino]acetamide?
The canonical SMILES for 2-(2-methoxyphenoxy)-N-[(Z)-[(3S)-3-methylpentan-2-ylidene]amino]acetamide is CC[C@H](C)/C(C)=N\NC(=O)COc1ccccc1OC.
What is the InChIKey of 2-(2-methoxyphenoxy)-N-[(Z)-[(3S)-3-methylpentan-2-ylidene]amino]acetamide?
The InChIKey is PRXNNRZQEQFDQJ-SPSOFYIISA-N. The full InChI is InChI=1S/C15H22N2O3/c1-5-11(2)12(3)16-17-15(18)10-20-14-9-7-6-8-13(14)19-4/h6-9,11H,5,10H2,1-4H3,(H,17,18)/b16-12-/t11-/m0/s1.
What are the key properties of 2-(2-methoxyphenoxy)-N-[(Z)-[(3S)-3-methylpentan-2-ylidene]amino]acetamide?
2-(2-methoxyphenoxy)-N-[(Z)-[(3S)-3-methylpentan-2-ylidene]amino]acetamide has a molecular weight of 278.35 g/mol, XLogP of 2.61, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenoxy)-N-[(Z)-[(3S)-3-methylpentan-2-ylidene]amino]acetamide is sourced from PubChem (CID 9315778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).