N-(4-butan-2-yloxyphenyl)-2-(3,4-dimethylphenoxy)acetamide

C20H25NO3 — CID 17160586

IUPACN-(4-butan-2-yloxyphenyl)-2-(3,4-dimethylphenoxy)acetamide
SMILESCCC(C)Oc1ccc(NC(=O)COc2ccc(C)c(C)c2)cc1
InChIInChI=1S/C20H25NO3/c1-5-16(4)24-18-10-7-17(8-11-18)21-20(22)13-23-19-9-6-14(2)15(3)12-19/h6-12,16H,5,13H2,1-4H3,(H,21,22)
InChIKeyHFUZDXNZCKVCHQ-UHFFFAOYSA-N
MW327.42 g/mol
LogP4.50
Rot. Bonds7

About N-(4-butan-2-yloxyphenyl)-2-(3,4-dimethylphenoxy)acetamide

N-(4-butan-2-yloxyphenyl)-2-(3,4-dimethylphenoxy)acetamide (PubChem CID 17160586) has the molecular formula C20H25NO3 and a molecular weight of 327.42 g/mol. Its IUPAC name is N-(4-butan-2-yloxyphenyl)-2-(3,4-dimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-(4-butan-2-yloxyphenyl)-2-(3,4-dimethylphenoxy)acetamide
PubChem CID17160586
Molecular FormulaC20H25NO3
Molecular Weight327.42 g/mol
Exact Mass327.18
IUPAC NameN-(4-butan-2-yloxyphenyl)-2-(3,4-dimethylphenoxy)acetamide
SMILESCCC(C)Oc1ccc(NC(=O)COc2ccc(C)c(C)c2)cc1
InChIInChI=1S/C20H25NO3/c1-5-16(4)24-18-10-7-17(8-11-18)21-20(22)13-23-19-9-6-14(2)15(3)12-19/h6-12,16H,5,13H2,1-4H3,(H,21,22)
InChIKeyHFUZDXNZCKVCHQ-UHFFFAOYSA-N
XLogP4.50
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.42
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(4-butan-2-yloxyphenyl)-2-(3,4-dimethylphenoxy)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[4-[[2-(3,4-dimethylphenoxy)acetyl]amino]phenoxy]acetate
CID 7316235
2-(3,4-dimethylphenoxy)-N-(4-methylsulfanylphenyl)acetamide
CID 9153670
2-(3,4-dimethylphenoxy)-N-(4-nitrophenyl)acetamide
CID 4930992
N-(4-butan-2-yloxyphenyl)-2-(3-chloro-4-methylanilino)acetamide
CID 54815837
N-(4-butan-2-yloxyphenyl)-2-(2,5-dimethylanilino)acetamide
CID 54812967
N-[3-[[2-(3,4-dimethylphenoxy)acetyl]amino]phenyl]propanamide
CID 17188267
2-(3,4-dimethylphenoxy)-N-(4-phenylsulfanylphenyl)acetamide
CID 1121779
4-[[2-(3,4-dimethylphenoxy)acetyl]amino]-N-phenylbenzamide
CID 17359274
2-(3,4-dimethylphenoxy)-N-(4-phenylmethoxyphenyl)acetamide
CID 4947508
N-(3,5-dichlorophenyl)-2-(3,4-dimethylphenoxy)acetamide
CID 879851
N-(4-butan-2-yloxyphenyl)acetamide
CID 17142081
2-(4-butan-2-yloxyanilino)-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide
CID 54830155

Frequently Asked Questions

What is the IUPAC name of N-(4-butan-2-yloxyphenyl)-2-(3,4-dimethylphenoxy)acetamide?
The IUPAC name of N-(4-butan-2-yloxyphenyl)-2-(3,4-dimethylphenoxy)acetamide (CID 17160586) is N-(4-butan-2-yloxyphenyl)-2-(3,4-dimethylphenoxy)acetamide.
What is the SMILES notation for N-(4-butan-2-yloxyphenyl)-2-(3,4-dimethylphenoxy)acetamide?
The canonical SMILES for N-(4-butan-2-yloxyphenyl)-2-(3,4-dimethylphenoxy)acetamide is CCC(C)Oc1ccc(NC(=O)COc2ccc(C)c(C)c2)cc1.
What is the InChIKey of N-(4-butan-2-yloxyphenyl)-2-(3,4-dimethylphenoxy)acetamide?
The InChIKey is HFUZDXNZCKVCHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO3/c1-5-16(4)24-18-10-7-17(8-11-18)21-20(22)13-23-19-9-6-14(2)15(3)12-19/h6-12,16H,5,13H2,1-4H3,(H,21,22).
What are the key properties of N-(4-butan-2-yloxyphenyl)-2-(3,4-dimethylphenoxy)acetamide?
N-(4-butan-2-yloxyphenyl)-2-(3,4-dimethylphenoxy)acetamide has a molecular weight of 327.42 g/mol, XLogP of 4.50, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-butan-2-yloxyphenyl)-2-(3,4-dimethylphenoxy)acetamide is sourced from PubChem (CID 17160586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).