2-(3,4-dimethylphenoxy)-N-(2-propan-2-ylphenyl)propanamide

C20H25NO2 — CID 53266174

IUPAC2-(3,4-dimethylphenoxy)-N-(2-propan-2-ylphenyl)propanamide
SMILESCc1ccc(OC(C)C(=O)Nc2ccccc2C(C)C)cc1C
InChIInChI=1S/C20H25NO2/c1-13(2)18-8-6-7-9-19(18)21-20(22)16(5)23-17-11-10-14(3)15(4)12-17/h6-13,16H,1-5H3,(H,21,22)
InChIKeyBWQUZMUHFFUJBG-UHFFFAOYSA-N
MW311.43 g/mol
LogP4.83
Rot. Bonds5

About 2-(3,4-dimethylphenoxy)-N-(2-propan-2-ylphenyl)propanamide

2-(3,4-dimethylphenoxy)-N-(2-propan-2-ylphenyl)propanamide (PubChem CID 53266174) has the molecular formula C20H25NO2 and a molecular weight of 311.43 g/mol. Its IUPAC name is 2-(3,4-dimethylphenoxy)-N-(2-propan-2-ylphenyl)propanamide.

Molecular Properties

Compound Name2-(3,4-dimethylphenoxy)-N-(2-propan-2-ylphenyl)propanamide
PubChem CID53266174
Molecular FormulaC20H25NO2
Molecular Weight311.43 g/mol
Exact Mass311.19
IUPAC Name2-(3,4-dimethylphenoxy)-N-(2-propan-2-ylphenyl)propanamide
SMILESCc1ccc(OC(C)C(=O)Nc2ccccc2C(C)C)cc1C
InChIInChI=1S/C20H25NO2/c1-13(2)18-8-6-7-9-19(18)21-20(22)16(5)23-17-11-10-14(3)15(4)12-17/h6-13,16H,1-5H3,(H,21,22)
InChIKeyBWQUZMUHFFUJBG-UHFFFAOYSA-N
XLogP4.83
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(3,4-dimethylphenoxy)-N-(2-methylphenyl)propanamide
CID 95077645
2-(3,4-dimethylphenoxy)-N-(2-methylsulfanylphenyl)propanamide
CID 53286343
2-(3,4-dimethylphenoxy)-N-(2-methoxyphenyl)propanamide
CID 17340995
2-(3-methyl-4-nitrophenoxy)-N-(2-propan-2-ylphenyl)propanamide
CID 24500733
2-(3,4-dimethylphenoxy)-N-(2-methyl-6-propan-2-ylphenyl)propanamide
CID 53266192
(2R)-2-(3-methylphenoxy)-N-(2-propan-2-ylphenyl)propanamide
CID 841227
2-[2-[2-(3-methyl-4-propan-2-ylphenoxy)propanoylamino]phenyl]acetic acid
CID 119218546
2-(4-ethylphenoxy)-N-(2-propan-2-ylphenyl)propanamide
CID 17093767
2-(4-methyl-2-oxochromen-7-yl)oxy-N-(2-propan-2-ylphenyl)propanamide
CID 19191726
(2R)-2-(2-propan-2-ylphenoxy)-N-(2-propan-2-ylphenyl)propanamide
CID 28636193
(2S)-2-(2-propan-2-ylphenoxy)-N-(2-propan-2-ylphenyl)propanamide
CID 28636194
(2R)-N-[2-[(2R)-butan-2-yl]phenyl]-2-(4-chloro-3-methylphenoxy)propanamide
CID 7542731

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylphenoxy)-N-(2-propan-2-ylphenyl)propanamide?
The IUPAC name of 2-(3,4-dimethylphenoxy)-N-(2-propan-2-ylphenyl)propanamide (CID 53266174) is 2-(3,4-dimethylphenoxy)-N-(2-propan-2-ylphenyl)propanamide.
What is the SMILES notation for 2-(3,4-dimethylphenoxy)-N-(2-propan-2-ylphenyl)propanamide?
The canonical SMILES for 2-(3,4-dimethylphenoxy)-N-(2-propan-2-ylphenyl)propanamide is Cc1ccc(OC(C)C(=O)Nc2ccccc2C(C)C)cc1C.
What is the InChIKey of 2-(3,4-dimethylphenoxy)-N-(2-propan-2-ylphenyl)propanamide?
The InChIKey is BWQUZMUHFFUJBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO2/c1-13(2)18-8-6-7-9-19(18)21-20(22)16(5)23-17-11-10-14(3)15(4)12-17/h6-13,16H,1-5H3,(H,21,22).
What are the key properties of 2-(3,4-dimethylphenoxy)-N-(2-propan-2-ylphenyl)propanamide?
2-(3,4-dimethylphenoxy)-N-(2-propan-2-ylphenyl)propanamide has a molecular weight of 311.43 g/mol, XLogP of 4.83, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylphenoxy)-N-(2-propan-2-ylphenyl)propanamide is sourced from PubChem (CID 53266174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).