N-(3-methylphenyl)-2-[(4-methylphenyl)methoxyamino]acetamide

C17H20N2O2 — CID 89234426

IUPACN-(3-methylphenyl)-2-[(4-methylphenyl)methoxyamino]acetamide
SMILESCc1ccc(CONCC(=O)Nc2cccc(C)c2)cc1
InChIInChI=1S/C17H20N2O2/c1-13-6-8-15(9-7-13)12-21-18-11-17(20)19-16-5-3-4-14(2)10-16/h3-10,18H,11-12H2,1-2H3,(H,19,20)
InChIKeyGNCOXQCDJNVZAE-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.96
Rot. Bonds6

About N-(3-methylphenyl)-2-[(4-methylphenyl)methoxyamino]acetamide

N-(3-methylphenyl)-2-[(4-methylphenyl)methoxyamino]acetamide (PubChem CID 89234426) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-(3-methylphenyl)-2-[(4-methylphenyl)methoxyamino]acetamide.

Molecular Properties

Compound NameN-(3-methylphenyl)-2-[(4-methylphenyl)methoxyamino]acetamide
PubChem CID89234426
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-(3-methylphenyl)-2-[(4-methylphenyl)methoxyamino]acetamide
SMILESCc1ccc(CONCC(=O)Nc2cccc(C)c2)cc1
InChIInChI=1S/C17H20N2O2/c1-13-6-8-15(9-7-13)12-21-18-11-17(20)19-16-5-3-4-14(2)10-16/h3-10,18H,11-12H2,1-2H3,(H,19,20)
InChIKeyGNCOXQCDJNVZAE-UHFFFAOYSA-N
XLogP2.96
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-methylphenyl)-2-(2-methylpropoxyamino)acetamide
CID 82715291
2-[4-(aminomethyl)phenyl]-N-(3-methylphenyl)acetamide
CID 63590654
[2-(3-methylanilino)-2-oxoethyl] 4-(methoxymethyl)benzoate
CID 7588243
methyl-[2-(3-methylanilino)-2-oxoethyl]-[2-(4-methylanilino)-2-oxoethyl]azanium
CID 8007094
[2-(3-methylanilino)-2-oxoethyl] acetate
CID 531943
1-(3-methylphenyl)-3-(4-methylphenyl)urea
CID 12560219
2-(4-methoxy-3-methylphenyl)-N-(3-methylphenyl)acetamide
CID 16848486
N-(3-methylphenyl)-4-(propan-2-yloxymethyl)benzamide
CID 8573875
2-[4-(hydroxymethyl)phenoxy]-N-(3-methylphenyl)acetamide
CID 28561560
N-(3-methylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604930
2-(3-methylphenoxy)-N-(3-methylphenyl)acetamide
CID 2787094
2-[[2-(3-methylanilino)-2-oxoethyl]amino]propanoic acid
CID 43467219

Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)-2-[(4-methylphenyl)methoxyamino]acetamide?
The IUPAC name of N-(3-methylphenyl)-2-[(4-methylphenyl)methoxyamino]acetamide (CID 89234426) is N-(3-methylphenyl)-2-[(4-methylphenyl)methoxyamino]acetamide.
What is the SMILES notation for N-(3-methylphenyl)-2-[(4-methylphenyl)methoxyamino]acetamide?
The canonical SMILES for N-(3-methylphenyl)-2-[(4-methylphenyl)methoxyamino]acetamide is Cc1ccc(CONCC(=O)Nc2cccc(C)c2)cc1.
What is the InChIKey of N-(3-methylphenyl)-2-[(4-methylphenyl)methoxyamino]acetamide?
The InChIKey is GNCOXQCDJNVZAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-13-6-8-15(9-7-13)12-21-18-11-17(20)19-16-5-3-4-14(2)10-16/h3-10,18H,11-12H2,1-2H3,(H,19,20).
What are the key properties of N-(3-methylphenyl)-2-[(4-methylphenyl)methoxyamino]acetamide?
N-(3-methylphenyl)-2-[(4-methylphenyl)methoxyamino]acetamide has a molecular weight of 284.36 g/mol, XLogP of 2.96, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)-2-[(4-methylphenyl)methoxyamino]acetamide is sourced from PubChem (CID 89234426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).