N-[(Z)-(2-methoxyphenyl)methylideneamino]-2-morpholin-4-ylacetamide

C14H19N3O3 — CID 5426268

IUPACN-[(Z)-(2-methoxyphenyl)methylideneamino]-2-morpholin-4-ylacetamide
SMILESCOc1ccccc1/C=N\NC(=O)CN1CCOCC1
InChIInChI=1S/C14H19N3O3/c1-19-13-5-3-2-4-12(13)10-15-16-14(18)11-17-6-8-20-9-7-17/h2-5,10H,6-9,11H2,1H3,(H,16,18)/b15-10-
InChIKeyQDXAIUARQAVMRC-GDNBJRDFSA-N
MW277.32 g/mol
LogP0.48
Rot. Bonds5

About N-[(Z)-(2-methoxyphenyl)methylideneamino]-2-morpholin-4-ylacetamide

N-[(Z)-(2-methoxyphenyl)methylideneamino]-2-morpholin-4-ylacetamide (PubChem CID 5426268) has the molecular formula C14H19N3O3 and a molecular weight of 277.32 g/mol. Its IUPAC name is N-[(Z)-(2-methoxyphenyl)methylideneamino]-2-morpholin-4-ylacetamide.

Molecular Properties

Compound NameN-[(Z)-(2-methoxyphenyl)methylideneamino]-2-morpholin-4-ylacetamide
PubChem CID5426268
Molecular FormulaC14H19N3O3
Molecular Weight277.32 g/mol
Exact Mass277.14
IUPAC NameN-[(Z)-(2-methoxyphenyl)methylideneamino]-2-morpholin-4-ylacetamide
SMILESCOc1ccccc1/C=N\NC(=O)CN1CCOCC1
InChIInChI=1S/C14H19N3O3/c1-19-13-5-3-2-4-12(13)10-15-16-14(18)11-17-6-8-20-9-7-17/h2-5,10H,6-9,11H2,1H3,(H,16,18)/b15-10-
InChIKeyQDXAIUARQAVMRC-GDNBJRDFSA-N
XLogP0.48
TPSA63.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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-(4-benzylpiperazin-1-yl)-N-[(E)-(2-methoxyphenyl)methylideneamino]acetamide
CID 6866404
2-[(Z)-[(2-morpholin-4-ylacetyl)hydrazinylidene]methyl]benzoic acid
CID 5426552
N-[(E)-(2-chloro-4,5-dimethoxyphenyl)methylideneamino]-2-morpholin-4-ylacetamide
CID 6877310
N-[(E)-(2-methoxynaphthalen-1-yl)methylideneamino]-2-morpholin-4-ylacetamide
CID 75124053
N-[(E)-[2-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-2-morpholin-4-ylacetamide
CID 21212526
N-[[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]-2-morpholin-4-ylacetamide
CID 1231188
N-[(Z)-(2,3-dibromo-4-hydroxy-5-methoxyphenyl)methylideneamino]-2-morpholin-4-ylacetamide
CID 135905102
N-[(Z)-(4-hydroxy-3-methoxyphenyl)methylideneamino]-2-morpholin-4-ylacetamide
CID 135956316
N-[(E)-(4,5-dimethoxy-2-nitrophenyl)methylideneamino]-2-morpholin-4-ylacetamide
CID 5344300
N-[(E)-(2-methoxyphenyl)methylideneamino]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide
CID 42991466
2-cyano-N-[(2-methoxyphenyl)methylideneamino]acetamide
CID 739635
N-[(Z)-(2-bromo-5-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]-2-morpholin-4-ylacetamide
CID 6063985

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(2-methoxyphenyl)methylideneamino]-2-morpholin-4-ylacetamide?
The IUPAC name of N-[(Z)-(2-methoxyphenyl)methylideneamino]-2-morpholin-4-ylacetamide (CID 5426268) is N-[(Z)-(2-methoxyphenyl)methylideneamino]-2-morpholin-4-ylacetamide.
What is the SMILES notation for N-[(Z)-(2-methoxyphenyl)methylideneamino]-2-morpholin-4-ylacetamide?
The canonical SMILES for N-[(Z)-(2-methoxyphenyl)methylideneamino]-2-morpholin-4-ylacetamide is COc1ccccc1/C=N\NC(=O)CN1CCOCC1.
What is the InChIKey of N-[(Z)-(2-methoxyphenyl)methylideneamino]-2-morpholin-4-ylacetamide?
The InChIKey is QDXAIUARQAVMRC-GDNBJRDFSA-N. The full InChI is InChI=1S/C14H19N3O3/c1-19-13-5-3-2-4-12(13)10-15-16-14(18)11-17-6-8-20-9-7-17/h2-5,10H,6-9,11H2,1H3,(H,16,18)/b15-10-.
What are the key properties of N-[(Z)-(2-methoxyphenyl)methylideneamino]-2-morpholin-4-ylacetamide?
N-[(Z)-(2-methoxyphenyl)methylideneamino]-2-morpholin-4-ylacetamide has a molecular weight of 277.32 g/mol, XLogP of 0.48, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(2-methoxyphenyl)methylideneamino]-2-morpholin-4-ylacetamide is sourced from PubChem (CID 5426268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).