N-(4-butylphenyl)-2-(2,5-dimethylphenoxy)acetamide

C20H25NO2 — CID 19167555

IUPACN-(4-butylphenyl)-2-(2,5-dimethylphenoxy)acetamide
SMILESCCCCc1ccc(NC(=O)COc2cc(C)ccc2C)cc1
InChIInChI=1S/C20H25NO2/c1-4-5-6-17-9-11-18(12-10-17)21-20(22)14-23-19-13-15(2)7-8-16(19)3/h7-13H,4-6,14H2,1-3H3,(H,21,22)
InChIKeyFITLZUNZXVZHKF-UHFFFAOYSA-N
MW311.43 g/mol
LogP4.66
Rot. Bonds7

About N-(4-butylphenyl)-2-(2,5-dimethylphenoxy)acetamide

N-(4-butylphenyl)-2-(2,5-dimethylphenoxy)acetamide (PubChem CID 19167555) has the molecular formula C20H25NO2 and a molecular weight of 311.43 g/mol. Its IUPAC name is N-(4-butylphenyl)-2-(2,5-dimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-(4-butylphenyl)-2-(2,5-dimethylphenoxy)acetamide
PubChem CID19167555
Molecular FormulaC20H25NO2
Molecular Weight311.43 g/mol
Exact Mass311.19
IUPAC NameN-(4-butylphenyl)-2-(2,5-dimethylphenoxy)acetamide
SMILESCCCCc1ccc(NC(=O)COc2cc(C)ccc2C)cc1
InChIInChI=1S/C20H25NO2/c1-4-5-6-17-9-11-18(12-10-17)21-20(22)14-23-19-13-15(2)7-8-16(19)3/h7-13H,4-6,14H2,1-3H3,(H,21,22)
InChIKeyFITLZUNZXVZHKF-UHFFFAOYSA-N
XLogP4.66
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-[[2-(2,5-dimethylphenoxy)acetyl]amino]phenyl]-N-methylacetamide
CID 35364916
2-[5-(aminomethyl)-2-methylphenoxy]-N-(4-methylphenyl)acetamide
CID 107655851
2-(2,5-dimethylphenoxy)-N-heptylacetamide
CID 3468528
2-(2,5-dimethylphenoxy)-N-[4-(propylsulfamoyl)phenyl]acetamide
CID 4932601
2-(2,5-dimethylphenoxy)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 17071565
N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-(2,5-dimethylphenoxy)acetamide
CID 8918792
2-methoxyethyl 4-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzoate
CID 19167161
1-[[2-(2,5-dimethylphenoxy)acetyl]amino]-3-(4-ethylphenyl)thiourea
CID 7988123
N-[3-[[2-(2,5-dimethylphenoxy)acetyl]amino]phenyl]propanamide
CID 17188255
2-(2,4-dimethylphenoxy)-N-(4-pentoxyphenyl)acetamide
CID 19166514
methyl 2-[2-(4-butylanilino)-2-oxoethoxy]benzoate
CID 7764225
3-[4-[[2-(2,4-dimethylphenoxy)acetyl]amino]phenyl]-N-methylpropanamide
CID 54780793

Frequently Asked Questions

What is the IUPAC name of N-(4-butylphenyl)-2-(2,5-dimethylphenoxy)acetamide?
The IUPAC name of N-(4-butylphenyl)-2-(2,5-dimethylphenoxy)acetamide (CID 19167555) is N-(4-butylphenyl)-2-(2,5-dimethylphenoxy)acetamide.
What is the SMILES notation for N-(4-butylphenyl)-2-(2,5-dimethylphenoxy)acetamide?
The canonical SMILES for N-(4-butylphenyl)-2-(2,5-dimethylphenoxy)acetamide is CCCCc1ccc(NC(=O)COc2cc(C)ccc2C)cc1.
What is the InChIKey of N-(4-butylphenyl)-2-(2,5-dimethylphenoxy)acetamide?
The InChIKey is FITLZUNZXVZHKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO2/c1-4-5-6-17-9-11-18(12-10-17)21-20(22)14-23-19-13-15(2)7-8-16(19)3/h7-13H,4-6,14H2,1-3H3,(H,21,22).
What are the key properties of N-(4-butylphenyl)-2-(2,5-dimethylphenoxy)acetamide?
N-(4-butylphenyl)-2-(2,5-dimethylphenoxy)acetamide has a molecular weight of 311.43 g/mol, XLogP of 4.66, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-butylphenyl)-2-(2,5-dimethylphenoxy)acetamide is sourced from PubChem (CID 19167555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).