N-[4-[(4-phenylmethoxyphenyl)methylideneamino]phenyl]acetamide

C22H20N2O2 — CID 693499

IUPACN-[4-[(4-phenylmethoxyphenyl)methylideneamino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(/N=C/c2ccc(OCc3ccccc3)cc2)cc1
InChIInChI=1S/C22H20N2O2/c1-17(25)24-21-11-9-20(10-12-21)23-15-18-7-13-22(14-8-18)26-16-19-5-3-2-4-6-19/h2-15H,16H2,1H3,(H,24,25)/b23-15+
InChIKeyMQVUPCKTWKAUGE-HZHRSRAPSA-N
MW344.41 g/mol
LogP4.97
Rot. Bonds6

About N-[4-[(4-phenylmethoxyphenyl)methylideneamino]phenyl]acetamide

N-[4-[(4-phenylmethoxyphenyl)methylideneamino]phenyl]acetamide (PubChem CID 693499) has the molecular formula C22H20N2O2 and a molecular weight of 344.41 g/mol. Its IUPAC name is N-[4-[(4-phenylmethoxyphenyl)methylideneamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(4-phenylmethoxyphenyl)methylideneamino]phenyl]acetamide
PubChem CID693499
Molecular FormulaC22H20N2O2
Molecular Weight344.41 g/mol
Exact Mass344.15
IUPAC NameN-[4-[(4-phenylmethoxyphenyl)methylideneamino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(/N=C/c2ccc(OCc3ccccc3)cc2)cc1
InChIInChI=1S/C22H20N2O2/c1-17(25)24-21-11-9-20(10-12-21)23-15-18-7-13-22(14-8-18)26-16-19-5-3-2-4-6-19/h2-15H,16H2,1H3,(H,24,25)/b23-15+
InChIKeyMQVUPCKTWKAUGE-HZHRSRAPSA-N
XLogP4.97
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-[(4-phenylmethoxyphenyl)methylideneamino]benzamide
CID 792365
[4-[(4-acetamidophenyl)iminomethyl]phenyl] benzoate
CID 1116148
N,N-dimethyl-4-[(4-phenylmethoxyphenyl)iminomethyl]aniline
CID 23965821
propyl 4-[(4-phenylmethoxyphenyl)methylideneamino]benzoate
CID 4504442
3-(4-phenylmethoxyanilino)but-2-enoic acid
CID 154014909
N-[4-[(4-phenylmethoxyphenyl)methylideneamino]-1,2,5-oxadiazol-3-yl]acetamide
CID 23961099
N-phenyl-N'-[(4-phenylmethoxyphenyl)methylideneamino]propanediamide
CID 3990065
2-[4-[(4-methoxyphenyl)iminomethyl]phenoxy]-N-phenylacetamide
CID 94832090
N-(4-ethylphenyl)-N'-[(4-phenylmethoxyphenyl)methylideneamino]oxamide
CID 3862743
N-[4-[(4-ethoxyphenyl)methylideneamino]phenyl]propanamide
CID 835020
N,N'-bis[(4-phenylmethoxyphenyl)methylideneamino]butanediamide
CID 3730577
1-[4-[(4-bromophenyl)methoxy]phenyl]-N-phenylmethanimine
CID 126217743

Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-phenylmethoxyphenyl)methylideneamino]phenyl]acetamide?
The IUPAC name of N-[4-[(4-phenylmethoxyphenyl)methylideneamino]phenyl]acetamide (CID 693499) is N-[4-[(4-phenylmethoxyphenyl)methylideneamino]phenyl]acetamide.
What is the SMILES notation for N-[4-[(4-phenylmethoxyphenyl)methylideneamino]phenyl]acetamide?
The canonical SMILES for N-[4-[(4-phenylmethoxyphenyl)methylideneamino]phenyl]acetamide is CC(=O)Nc1ccc(/N=C/c2ccc(OCc3ccccc3)cc2)cc1.
What is the InChIKey of N-[4-[(4-phenylmethoxyphenyl)methylideneamino]phenyl]acetamide?
The InChIKey is MQVUPCKTWKAUGE-HZHRSRAPSA-N. The full InChI is InChI=1S/C22H20N2O2/c1-17(25)24-21-11-9-20(10-12-21)23-15-18-7-13-22(14-8-18)26-16-19-5-3-2-4-6-19/h2-15H,16H2,1H3,(H,24,25)/b23-15+.
What are the key properties of N-[4-[(4-phenylmethoxyphenyl)methylideneamino]phenyl]acetamide?
N-[4-[(4-phenylmethoxyphenyl)methylideneamino]phenyl]acetamide has a molecular weight of 344.41 g/mol, XLogP of 4.97, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4-phenylmethoxyphenyl)methylideneamino]phenyl]acetamide is sourced from PubChem (CID 693499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).