2-(2-tert-butylphenoxy)-N-(3-methylphenyl)propanamide

C20H25NO2 — CID 53266482

IUPAC2-(2-tert-butylphenoxy)-N-(3-methylphenyl)propanamide
SMILESCc1cccc(NC(=O)C(C)Oc2ccccc2C(C)(C)C)c1
InChIInChI=1S/C20H25NO2/c1-14-9-8-10-16(13-14)21-19(22)15(2)23-18-12-7-6-11-17(18)20(3,4)5/h6-13,15H,1-5H3,(H,21,22)
InChIKeyCKNCZNYMWBHCRW-UHFFFAOYSA-N
MW311.43 g/mol
LogP4.70
Rot. Bonds4

About 2-(2-tert-butylphenoxy)-N-(3-methylphenyl)propanamide

2-(2-tert-butylphenoxy)-N-(3-methylphenyl)propanamide (PubChem CID 53266482) has the molecular formula C20H25NO2 and a molecular weight of 311.43 g/mol. Its IUPAC name is 2-(2-tert-butylphenoxy)-N-(3-methylphenyl)propanamide.

Molecular Properties

Compound Name2-(2-tert-butylphenoxy)-N-(3-methylphenyl)propanamide
PubChem CID53266482
Molecular FormulaC20H25NO2
Molecular Weight311.43 g/mol
Exact Mass311.19
IUPAC Name2-(2-tert-butylphenoxy)-N-(3-methylphenyl)propanamide
SMILESCc1cccc(NC(=O)C(C)Oc2ccccc2C(C)(C)C)c1
InChIInChI=1S/C20H25NO2/c1-14-9-8-10-16(13-14)21-19(22)15(2)23-18-12-7-6-11-17(18)20(3,4)5/h6-13,15H,1-5H3,(H,21,22)
InChIKeyCKNCZNYMWBHCRW-UHFFFAOYSA-N
XLogP4.70
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2-tert-butylphenoxy)-N-(3-methylphenyl)propanamide 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

(2R)-2-(2,4-dimethylphenoxy)-N-(3-methylphenyl)propanamide
CID 837579
(2S)-2-(2,4-dimethylphenoxy)-N-(3-methylphenyl)propanamide
CID 837580
2-[(2R)-1-(3-methylanilino)-1-oxopropan-2-yl]oxy-N-phenylbenzamide
CID 7980902
(2R)-2-(3-methylphenoxy)-N-(3-methylphenyl)propanamide
CID 7946484
2-(3-methylphenoxy)-N-(3-methylphenyl)propanamide
CID 4931056
propyl 3-[2-(2-tert-butylphenoxy)propanoylamino]benzoate
CID 53266502
2-(2-tert-butylphenoxy)-N-(3-chloro-4-methoxyphenyl)propanamide
CID 53266361
(2S)-2-(2-methylphenoxy)-N-[3-[[(2R)-2-(2-methylphenoxy)propanoyl]amino]phenyl]propanamide
CID 1019898
N-(4-acetylphenyl)-2-(2-tert-butylphenoxy)propanamide
CID 53266435
(2R)-2-(4-fluorophenoxy)-N-(3-methylphenyl)propanamide
CID 26218148
(2R)-2-(2,4-dichlorophenoxy)-N-(3-methylphenyl)propanamide
CID 2164297
2-(2-tert-butylphenoxy)-N-(5-chloro-2-methylphenyl)propanamide
CID 53266580

Frequently Asked Questions

What is the IUPAC name of 2-(2-tert-butylphenoxy)-N-(3-methylphenyl)propanamide?
The IUPAC name of 2-(2-tert-butylphenoxy)-N-(3-methylphenyl)propanamide (CID 53266482) is 2-(2-tert-butylphenoxy)-N-(3-methylphenyl)propanamide.
What is the SMILES notation for 2-(2-tert-butylphenoxy)-N-(3-methylphenyl)propanamide?
The canonical SMILES for 2-(2-tert-butylphenoxy)-N-(3-methylphenyl)propanamide is Cc1cccc(NC(=O)C(C)Oc2ccccc2C(C)(C)C)c1.
What is the InChIKey of 2-(2-tert-butylphenoxy)-N-(3-methylphenyl)propanamide?
The InChIKey is CKNCZNYMWBHCRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO2/c1-14-9-8-10-16(13-14)21-19(22)15(2)23-18-12-7-6-11-17(18)20(3,4)5/h6-13,15H,1-5H3,(H,21,22).
What are the key properties of 2-(2-tert-butylphenoxy)-N-(3-methylphenyl)propanamide?
2-(2-tert-butylphenoxy)-N-(3-methylphenyl)propanamide has a molecular weight of 311.43 g/mol, XLogP of 4.70, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-tert-butylphenoxy)-N-(3-methylphenyl)propanamide is sourced from PubChem (CID 53266482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).