2-(2,5-dimethylphenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide

C20H25NO2 — CID 132650444

IUPAC2-(2,5-dimethylphenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide
SMILESCc1ccc(OCC(C)NC(=O)Cc2cc(C)ccc2C)cc1
InChIInChI=1S/C20H25NO2/c1-14-6-9-19(10-7-14)23-13-17(4)21-20(22)12-18-11-15(2)5-8-16(18)3/h5-11,17H,12-13H2,1-4H3,(H,21,22)
InChIKeyOJXCBCMKGAFWID-UHFFFAOYSA-N
MW311.43 g/mol
LogP3.74
Rot. Bonds6

About 2-(2,5-dimethylphenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide

2-(2,5-dimethylphenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide (PubChem CID 132650444) has the molecular formula C20H25NO2 and a molecular weight of 311.43 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide
PubChem CID132650444
Molecular FormulaC20H25NO2
Molecular Weight311.43 g/mol
Exact Mass311.19
IUPAC Name2-(2,5-dimethylphenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide
SMILESCc1ccc(OCC(C)NC(=O)Cc2cc(C)ccc2C)cc1
InChIInChI=1S/C20H25NO2/c1-14-6-9-19(10-7-14)23-13-17(4)21-20(22)12-18-11-15(2)5-8-16(18)3/h5-11,17H,12-13H2,1-4H3,(H,21,22)
InChIKeyOJXCBCMKGAFWID-UHFFFAOYSA-N
XLogP3.74
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(3,4-dimethylphenoxy)propan-2-yl]-2-(2,4-dimethylphenyl)acetamide
CID 133262161
N-[(2R)-1-(4-methoxyphenoxy)propan-2-yl]-2-(4-methylphenyl)acetamide
CID 92680005
2-(2-chlorophenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide
CID 133166961
4-hydroxy-N-[1-(4-methylphenoxy)propan-2-yl]butanamide
CID 79192194
2-(2,5-dimethylphenyl)-N-pent-4-yn-2-ylacetamide
CID 115662051
5-[[2-(2,5-dimethylphenyl)acetyl]amino]hexanoic acid
CID 82854155
(2S)-2-[[2-(2,5-dimethylphenyl)acetyl]amino]propanoic acid
CID 62538173
2,2-dimethyl-N-[(2S)-1-(4-methylphenoxy)propan-2-yl]propanamide
CID 52773928
N-[1-(4-methylphenoxy)propan-2-yl]-2-thiophen-2-ylacetamide
CID 47450824
ethyl 2-[[2-(2,5-dimethylphenyl)acetyl]amino]propanoate
CID 62538862
N-[1-(4-methylphenoxy)propan-2-yl]-2-naphthalen-2-yloxyacetamide
CID 132652959
2,5-dimethyl-N-[(2R)-1-phenoxypropan-2-yl]benzamide
CID 94625056

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide?
The IUPAC name of 2-(2,5-dimethylphenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide (CID 132650444) is 2-(2,5-dimethylphenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide.
What is the SMILES notation for 2-(2,5-dimethylphenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide?
The canonical SMILES for 2-(2,5-dimethylphenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide is Cc1ccc(OCC(C)NC(=O)Cc2cc(C)ccc2C)cc1.
What is the InChIKey of 2-(2,5-dimethylphenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide?
The InChIKey is OJXCBCMKGAFWID-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO2/c1-14-6-9-19(10-7-14)23-13-17(4)21-20(22)12-18-11-15(2)5-8-16(18)3/h5-11,17H,12-13H2,1-4H3,(H,21,22).
What are the key properties of 2-(2,5-dimethylphenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide?
2-(2,5-dimethylphenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide has a molecular weight of 311.43 g/mol, XLogP of 3.74, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide is sourced from PubChem (CID 132650444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).