(2Z)-N-(5-chloro-2-methoxyphenyl)-2-phenylmethoxyiminoacetamide

C16H15ClN2O3 — CID 7666843

IUPAC(2Z)-N-(5-chloro-2-methoxyphenyl)-2-phenylmethoxyiminoacetamide
SMILESCOc1ccc(Cl)cc1NC(=O)/C=N\OCc1ccccc1
InChIInChI=1S/C16H15ClN2O3/c1-21-15-8-7-13(17)9-14(15)19-16(20)10-18-22-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,19,20)/b18-10-
InChIKeyDBUMPJMYEFYMFU-ZDLGFXPLSA-N
MW318.76 g/mol
LogP3.49
Rot. Bonds6

About (2Z)-N-(5-chloro-2-methoxyphenyl)-2-phenylmethoxyiminoacetamide

(2Z)-N-(5-chloro-2-methoxyphenyl)-2-phenylmethoxyiminoacetamide (PubChem CID 7666843) has the molecular formula C16H15ClN2O3 and a molecular weight of 318.76 g/mol. Its IUPAC name is (2Z)-N-(5-chloro-2-methoxyphenyl)-2-phenylmethoxyiminoacetamide.

Molecular Properties

Compound Name(2Z)-N-(5-chloro-2-methoxyphenyl)-2-phenylmethoxyiminoacetamide
PubChem CID7666843
Molecular FormulaC16H15ClN2O3
Molecular Weight318.76 g/mol
Exact Mass318.08
IUPAC Name(2Z)-N-(5-chloro-2-methoxyphenyl)-2-phenylmethoxyiminoacetamide
SMILESCOc1ccc(Cl)cc1NC(=O)/C=N\OCc1ccccc1
InChIInChI=1S/C16H15ClN2O3/c1-21-15-8-7-13(17)9-14(15)19-16(20)10-18-22-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,19,20)/b18-10-
InChIKeyDBUMPJMYEFYMFU-ZDLGFXPLSA-N
XLogP3.49
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.76
LogP ≤ 53.49
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

(2Z)-N-(5-chloro-2-methoxyphenyl)-2-[2-(4-methylphenoxy)ethoxyimino]acetamide
CID 7667218
2-[(Z)-[2-(5-chloro-2-methoxyanilino)-2-oxoethylidene]amino]oxy-N-(4-fluorophenyl)acetamide
CID 7666973
2-[(Z)-[2-(5-chloro-2-methoxyanilino)-2-oxoethylidene]amino]oxy-N-(3,4-dimethylphenyl)acetamide
CID 7666877
2-[(Z)-[2-(5-chloro-2-methoxyanilino)-2-oxoethylidene]amino]oxy-N-cyclopentylacetamide
CID 7666999
N-(5-chloro-2-methoxyphenyl)-2-(4-phenylmethoxyphenoxy)acetamide
CID 4783296
N-[4-[(2R)-butan-2-yl]phenyl]-2-[(Z)-[2-(5-chloro-2-methoxyanilino)-2-oxoethylidene]amino]oxyacetamide
CID 7666981
N-[4-[(2S)-butan-2-yl]phenyl]-2-[(Z)-[2-(5-chloro-2-methoxyanilino)-2-oxoethylidene]amino]oxyacetamide
CID 7666986
2-[(Z)-[2-(5-chloro-2-methoxyanilino)-2-oxoethylidene]amino]oxy-N-[(1R,2S)-2-methylcyclohexyl]acetamide
CID 7667186
N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-2-phenylacetamide
CID 9413480
(E)-3-(1-benzylpyrazol-4-yl)-N-(5-chloro-2-methoxyphenyl)prop-2-enamide
CID 9073393
(E)-N-(5-chloro-2-methoxyphenyl)-3-phenylsulfanylprop-2-enamide
CID 9073408
cis-(1R,2S)-2-benzyl-N-(5-chloro-2-methoxyphenyl)cyclopropane-1-carboxamide
CID 158550362

Frequently Asked Questions

What is the IUPAC name of (2Z)-N-(5-chloro-2-methoxyphenyl)-2-phenylmethoxyiminoacetamide?
The IUPAC name of (2Z)-N-(5-chloro-2-methoxyphenyl)-2-phenylmethoxyiminoacetamide (CID 7666843) is (2Z)-N-(5-chloro-2-methoxyphenyl)-2-phenylmethoxyiminoacetamide.
What is the SMILES notation for (2Z)-N-(5-chloro-2-methoxyphenyl)-2-phenylmethoxyiminoacetamide?
The canonical SMILES for (2Z)-N-(5-chloro-2-methoxyphenyl)-2-phenylmethoxyiminoacetamide is COc1ccc(Cl)cc1NC(=O)/C=N\OCc1ccccc1.
What is the InChIKey of (2Z)-N-(5-chloro-2-methoxyphenyl)-2-phenylmethoxyiminoacetamide?
The InChIKey is DBUMPJMYEFYMFU-ZDLGFXPLSA-N. The full InChI is InChI=1S/C16H15ClN2O3/c1-21-15-8-7-13(17)9-14(15)19-16(20)10-18-22-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,19,20)/b18-10-.
What are the key properties of (2Z)-N-(5-chloro-2-methoxyphenyl)-2-phenylmethoxyiminoacetamide?
(2Z)-N-(5-chloro-2-methoxyphenyl)-2-phenylmethoxyiminoacetamide has a molecular weight of 318.76 g/mol, XLogP of 3.49, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-N-(5-chloro-2-methoxyphenyl)-2-phenylmethoxyiminoacetamide is sourced from PubChem (CID 7666843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).