2-(4-methylphenoxy)-N-(4-methylphenyl)-N-phenylacetamide

C22H21NO2 — CID 70115450

IUPAC2-(4-methylphenoxy)-N-(4-methylphenyl)-N-phenylacetamide
SMILESCc1ccc(OCC(=O)N(c2ccccc2)c2ccc(C)cc2)cc1
InChIInChI=1S/C22H21NO2/c1-17-8-12-20(13-9-17)23(19-6-4-3-5-7-19)22(24)16-25-21-14-10-18(2)11-15-21/h3-15H,16H2,1-2H3
InChIKeyLDXPNCXRLUIBQY-UHFFFAOYSA-N
MW331.42 g/mol
LogP5.05
Rot. Bonds5

About 2-(4-methylphenoxy)-N-(4-methylphenyl)-N-phenylacetamide

2-(4-methylphenoxy)-N-(4-methylphenyl)-N-phenylacetamide (PubChem CID 70115450) has the molecular formula C22H21NO2 and a molecular weight of 331.42 g/mol. Its IUPAC name is 2-(4-methylphenoxy)-N-(4-methylphenyl)-N-phenylacetamide.

Molecular Properties

Compound Name2-(4-methylphenoxy)-N-(4-methylphenyl)-N-phenylacetamide
PubChem CID70115450
Molecular FormulaC22H21NO2
Molecular Weight331.42 g/mol
Exact Mass331.16
IUPAC Name2-(4-methylphenoxy)-N-(4-methylphenyl)-N-phenylacetamide
SMILESCc1ccc(OCC(=O)N(c2ccccc2)c2ccc(C)cc2)cc1
InChIInChI=1S/C22H21NO2/c1-17-8-12-20(13-9-17)23(19-6-4-3-5-7-19)22(24)16-25-21-14-10-18(2)11-15-21/h3-15H,16H2,1-2H3
InChIKeyLDXPNCXRLUIBQY-UHFFFAOYSA-N
XLogP5.05
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500331.42
LogP ≤ 55.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(benzenesulfonyl)-2-(4-methylphenoxy)-N-(4-methylphenyl)acetamide
CID 19212675
N-(4-methylphenyl)-N-(4-methylphenyl)sulfonyl-2-phenoxyacetamide
CID 19212618
2-(4-bromophenoxy)-N-methyl-N-phenylacetamide
CID 888242
N-methoxy-N-methyl-2-(4-methylphenoxy)acetamide
CID 59178255
N-(benzenesulfonyl)-N-(4-ethylphenyl)-2-(4-methylphenoxy)acetamide
CID 19212677
(4-ethoxyphenyl)-[4-[4-(N-[4-(N-(4-methylphenyl)anilino)phenyl]anilino)phenoxy]phenyl]methanone
CID 71233054
N,N,N',N'-tetrakis(4-methylphenyl)propanediamide
CID 165110005
2-[4-(N-[4-[4-(N-[4-(carboxymethoxy)phenyl]anilino)phenyl]phenyl]anilino)phenoxy]acetic acid
CID 102587627
2-(4-methylphenoxy)-N-[4-(N-propan-2-ylanilino)phenyl]acetamide
CID 3602002
ethyl 3-[benzyl-[2-(4-methylphenoxy)acetyl]amino]propanoate
CID 43910600
2-[methyl-[2-(4-methylphenoxy)acetyl]amino]propanoic acid
CID 62626374
(4-ethoxyphenyl)-[4-[4-(N-[4-(N-(4-methylphenyl)anilino)phenyl]anilino)phenoxy]phenyl]methanone;phosphane
CID 159786480

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenoxy)-N-(4-methylphenyl)-N-phenylacetamide?
The IUPAC name of 2-(4-methylphenoxy)-N-(4-methylphenyl)-N-phenylacetamide (CID 70115450) is 2-(4-methylphenoxy)-N-(4-methylphenyl)-N-phenylacetamide.
What is the SMILES notation for 2-(4-methylphenoxy)-N-(4-methylphenyl)-N-phenylacetamide?
The canonical SMILES for 2-(4-methylphenoxy)-N-(4-methylphenyl)-N-phenylacetamide is Cc1ccc(OCC(=O)N(c2ccccc2)c2ccc(C)cc2)cc1.
What is the InChIKey of 2-(4-methylphenoxy)-N-(4-methylphenyl)-N-phenylacetamide?
The InChIKey is LDXPNCXRLUIBQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO2/c1-17-8-12-20(13-9-17)23(19-6-4-3-5-7-19)22(24)16-25-21-14-10-18(2)11-15-21/h3-15H,16H2,1-2H3.
What are the key properties of 2-(4-methylphenoxy)-N-(4-methylphenyl)-N-phenylacetamide?
2-(4-methylphenoxy)-N-(4-methylphenyl)-N-phenylacetamide has a molecular weight of 331.42 g/mol, XLogP of 5.05, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenoxy)-N-(4-methylphenyl)-N-phenylacetamide is sourced from PubChem (CID 70115450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).