2-(2-methoxyphenoxy)-N-[(Z)-(3-methylcyclohexylidene)amino]acetamide

C16H22N2O3 — CID 6527756

IUPAC2-(2-methoxyphenoxy)-N-[(Z)-(3-methylcyclohexylidene)amino]acetamide
SMILESCOc1ccccc1OCC(=O)N/N=C1/CCCC(C)C1
InChIInChI=1S/C16H22N2O3/c1-12-6-5-7-13(10-12)17-18-16(19)11-21-15-9-4-3-8-14(15)20-2/h3-4,8-9,12H,5-7,10-11H2,1-2H3,(H,18,19)/b17-13-
InChIKeyQNBPONQXJPHOIO-LGMDPLHJSA-N
MW290.36 g/mol
LogP2.76
Rot. Bonds5

About 2-(2-methoxyphenoxy)-N-[(Z)-(3-methylcyclohexylidene)amino]acetamide

2-(2-methoxyphenoxy)-N-[(Z)-(3-methylcyclohexylidene)amino]acetamide (PubChem CID 6527756) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is 2-(2-methoxyphenoxy)-N-[(Z)-(3-methylcyclohexylidene)amino]acetamide.

Molecular Properties

Compound Name2-(2-methoxyphenoxy)-N-[(Z)-(3-methylcyclohexylidene)amino]acetamide
PubChem CID6527756
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC Name2-(2-methoxyphenoxy)-N-[(Z)-(3-methylcyclohexylidene)amino]acetamide
SMILESCOc1ccccc1OCC(=O)N/N=C1/CCCC(C)C1
InChIInChI=1S/C16H22N2O3/c1-12-6-5-7-13(10-12)17-18-16(19)11-21-15-9-4-3-8-14(15)20-2/h3-4,8-9,12H,5-7,10-11H2,1-2H3,(H,18,19)/b17-13-
InChIKeyQNBPONQXJPHOIO-LGMDPLHJSA-N
XLogP2.76
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 52.76
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

N-[(Z)-[(3S)-3-methylcyclohexylidene]amino]-2-(2-phenylphenoxy)acetamide
CID 7530082
2-(2-methoxyphenoxy)-N-[(4-methylcyclohexylidene)amino]acetamide
CID 9315773
N-[[(2R,6S)-2,6-dimethylcyclohexylidene]amino]-2-(2-methoxyphenoxy)acetamide
CID 9315686
2-(2-methoxyphenoxy)-N-[(Z)-[(5R)-3,3,5-trimethylcyclohexylidene]amino]acetamide
CID 7689241
N-[(3-methylcyclohexylidene)amino]-2-(4-phenylphenoxy)acetamide
CID 3270935
2-(4-ethylphenoxy)-N-[(Z)-[(3S)-3-methylcyclohexylidene]amino]acetamide
CID 7823428
N-[(Z)-(3-methylcyclohexylidene)amino]-2-(4-nitrophenoxy)acetamide
CID 6916225
2-(4-chloro-3-methylphenoxy)-N-[(Z)-[(3R)-3-methylcyclohexylidene]amino]acetamide
CID 5419189
2-(2-methoxyphenoxy)-N-[(Z)-(3-methylcyclopent-2-en-1-ylidene)amino]acetamide
CID 7530089
2-(2-ethoxyphenoxy)-N-[(Z)-(3-oxocyclohexylidene)amino]acetamide
CID 6520128
[(E)-(3-methylcyclohexylidene)amino]urea
CID 5357776
N,N'-bis[(Z)-[(3R)-3-methylcyclohexylidene]amino]oxamide
CID 40543084

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenoxy)-N-[(Z)-(3-methylcyclohexylidene)amino]acetamide?
The IUPAC name of 2-(2-methoxyphenoxy)-N-[(Z)-(3-methylcyclohexylidene)amino]acetamide (CID 6527756) is 2-(2-methoxyphenoxy)-N-[(Z)-(3-methylcyclohexylidene)amino]acetamide.
What is the SMILES notation for 2-(2-methoxyphenoxy)-N-[(Z)-(3-methylcyclohexylidene)amino]acetamide?
The canonical SMILES for 2-(2-methoxyphenoxy)-N-[(Z)-(3-methylcyclohexylidene)amino]acetamide is COc1ccccc1OCC(=O)N/N=C1/CCCC(C)C1.
What is the InChIKey of 2-(2-methoxyphenoxy)-N-[(Z)-(3-methylcyclohexylidene)amino]acetamide?
The InChIKey is QNBPONQXJPHOIO-LGMDPLHJSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-12-6-5-7-13(10-12)17-18-16(19)11-21-15-9-4-3-8-14(15)20-2/h3-4,8-9,12H,5-7,10-11H2,1-2H3,(H,18,19)/b17-13-.
What are the key properties of 2-(2-methoxyphenoxy)-N-[(Z)-(3-methylcyclohexylidene)amino]acetamide?
2-(2-methoxyphenoxy)-N-[(Z)-(3-methylcyclohexylidene)amino]acetamide has a molecular weight of 290.36 g/mol, XLogP of 2.76, 5 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)-(3-methylcyclohexylidene)amino]acetamide is sourced from PubChem (CID 6527756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).