2-[[2-(2-benzylphenoxy)acetyl]amino]-N-(2,6-dimethylphenyl)acetamide

C25H26N2O3 — CID 24680148

IUPAC2-[[2-(2-benzylphenoxy)acetyl]amino]-N-(2,6-dimethylphenyl)acetamide
SMILESCc1cccc(C)c1NC(=O)CNC(=O)COc1ccccc1Cc1ccccc1
InChIInChI=1S/C25H26N2O3/c1-18-9-8-10-19(2)25(18)27-23(28)16-26-24(29)17-30-22-14-7-6-13-21(22)15-20-11-4-3-5-12-20/h3-14H,15-17H2,1-2H3,(H,26,29)(H,27,28)
InChIKeyQXUPEKVAPNWAFQ-UHFFFAOYSA-N
MW402.49 g/mol
LogP4.03
Rot. Bonds8

About 2-[[2-(2-benzylphenoxy)acetyl]amino]-N-(2,6-dimethylphenyl)acetamide

2-[[2-(2-benzylphenoxy)acetyl]amino]-N-(2,6-dimethylphenyl)acetamide (PubChem CID 24680148) has the molecular formula C25H26N2O3 and a molecular weight of 402.49 g/mol. Its IUPAC name is 2-[[2-(2-benzylphenoxy)acetyl]amino]-N-(2,6-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-[[2-(2-benzylphenoxy)acetyl]amino]-N-(2,6-dimethylphenyl)acetamide
PubChem CID24680148
Molecular FormulaC25H26N2O3
Molecular Weight402.49 g/mol
Exact Mass402.19
IUPAC Name2-[[2-(2-benzylphenoxy)acetyl]amino]-N-(2,6-dimethylphenyl)acetamide
SMILESCc1cccc(C)c1NC(=O)CNC(=O)COc1ccccc1Cc1ccccc1
InChIInChI=1S/C25H26N2O3/c1-18-9-8-10-19(2)25(18)27-23(28)16-26-24(29)17-30-22-14-7-6-13-21(22)15-20-11-4-3-5-12-20/h3-14H,15-17H2,1-2H3,(H,26,29)(H,27,28)
InChIKeyQXUPEKVAPNWAFQ-UHFFFAOYSA-N
XLogP4.03
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.49
LogP ≤ 54.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-benzylphenoxy)-N-(2,4,6-trimethylphenyl)acetamide
CID 7899812
N-(2,6-dimethylphenyl)-2-(2-ethylphenoxy)acetamide
CID 19175719
N-[2-(2,6-dimethylanilino)-2-oxoethyl]-2-phenylacetamide
CID 7676704
2-(2-benzylphenoxy)-N-methylacetamide
CID 7661700
2-(2-benzylphenoxy)-N-(2-methylpropyl)acetamide
CID 112779271
N-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]-2-phenylacetamide
CID 112997001
2-[[2-(2-benzylphenoxy)acetyl]amino]-N-(furan-2-ylmethyl)acetamide
CID 18118989
N'-[2-(2-benzylphenoxy)acetyl]-2-(3-methylphenoxy)acetohydrazide
CID 7943215
2-(2-benzylphenoxy)-N-(3-ethoxypropyl)acetamide
CID 78760776
2-(2-benzylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide
CID 60521789
methyl 2-(2-benzylphenoxy)acetate
CID 43237517
2-[[2-(2-methoxyphenoxy)acetyl]amino]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 112997414

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-benzylphenoxy)acetyl]amino]-N-(2,6-dimethylphenyl)acetamide?
The IUPAC name of 2-[[2-(2-benzylphenoxy)acetyl]amino]-N-(2,6-dimethylphenyl)acetamide (CID 24680148) is 2-[[2-(2-benzylphenoxy)acetyl]amino]-N-(2,6-dimethylphenyl)acetamide.
What is the SMILES notation for 2-[[2-(2-benzylphenoxy)acetyl]amino]-N-(2,6-dimethylphenyl)acetamide?
The canonical SMILES for 2-[[2-(2-benzylphenoxy)acetyl]amino]-N-(2,6-dimethylphenyl)acetamide is Cc1cccc(C)c1NC(=O)CNC(=O)COc1ccccc1Cc1ccccc1.
What is the InChIKey of 2-[[2-(2-benzylphenoxy)acetyl]amino]-N-(2,6-dimethylphenyl)acetamide?
The InChIKey is QXUPEKVAPNWAFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O3/c1-18-9-8-10-19(2)25(18)27-23(28)16-26-24(29)17-30-22-14-7-6-13-21(22)15-20-11-4-3-5-12-20/h3-14H,15-17H2,1-2H3,(H,26,29)(H,27,28).
What are the key properties of 2-[[2-(2-benzylphenoxy)acetyl]amino]-N-(2,6-dimethylphenyl)acetamide?
2-[[2-(2-benzylphenoxy)acetyl]amino]-N-(2,6-dimethylphenyl)acetamide has a molecular weight of 402.49 g/mol, XLogP of 4.03, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-benzylphenoxy)acetyl]amino]-N-(2,6-dimethylphenyl)acetamide is sourced from PubChem (CID 24680148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).