N-[2-(4-methylanilino)phenyl]-2-(3-propan-2-ylphenoxy)acetamide

C24H26N2O2 — CID 108745039

IUPACN-[2-(4-methylanilino)phenyl]-2-(3-propan-2-ylphenoxy)acetamide
SMILESCc1ccc(Nc2ccccc2NC(=O)COc2cccc(C(C)C)c2)cc1
InChIInChI=1S/C24H26N2O2/c1-17(2)19-7-6-8-21(15-19)28-16-24(27)26-23-10-5-4-9-22(23)25-20-13-11-18(3)12-14-20/h4-15,17,25H,16H2,1-3H3,(H,26,27)
InChIKeyOPZGQTWWJYMYQK-UHFFFAOYSA-N
MW374.48 g/mol
LogP5.88
Rot. Bonds7

About N-[2-(4-methylanilino)phenyl]-2-(3-propan-2-ylphenoxy)acetamide

N-[2-(4-methylanilino)phenyl]-2-(3-propan-2-ylphenoxy)acetamide (PubChem CID 108745039) has the molecular formula C24H26N2O2 and a molecular weight of 374.48 g/mol. Its IUPAC name is N-[2-(4-methylanilino)phenyl]-2-(3-propan-2-ylphenoxy)acetamide.

Molecular Properties

Compound NameN-[2-(4-methylanilino)phenyl]-2-(3-propan-2-ylphenoxy)acetamide
PubChem CID108745039
Molecular FormulaC24H26N2O2
Molecular Weight374.48 g/mol
Exact Mass374.20
IUPAC NameN-[2-(4-methylanilino)phenyl]-2-(3-propan-2-ylphenoxy)acetamide
SMILESCc1ccc(Nc2ccccc2NC(=O)COc2cccc(C(C)C)c2)cc1
InChIInChI=1S/C24H26N2O2/c1-17(2)19-7-6-8-21(15-19)28-16-24(27)26-23-10-5-4-9-22(23)25-20-13-11-18(3)12-14-20/h4-15,17,25H,16H2,1-3H3,(H,26,27)
InChIKeyOPZGQTWWJYMYQK-UHFFFAOYSA-N
XLogP5.88
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.48
LogP ≤ 55.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,4-dimethylphenoxy)-N-[2-(4-methylanilino)phenyl]acetamide
CID 108767360
N-(4-iodophenyl)-2-(3-propan-2-ylphenoxy)acetamide
CID 19176026
N-(2-anilinophenyl)-2-phenoxyacetamide
CID 23903366
N-(5-amino-2-methylphenyl)-2-(3-propan-2-ylphenoxy)acetamide
CID 16782919
2-[3-methyl-4-[[2-(3-propan-2-ylphenoxy)acetyl]amino]phenoxy]acetic acid
CID 119231617
2-[3-(1-hydroxyethyl)phenoxy]-N-(4-propan-2-ylphenyl)acetamide
CID 110884631
N-(2,5-dimethylphenyl)-2-[3-(1-hydroxyethyl)phenoxy]acetamide
CID 110884621
N-[2-(4-methylanilino)phenyl]-2-(2,3,6-trimethylphenoxy)acetamide
CID 108767365
N-(3-acetylphenyl)-2-(3-propan-2-ylphenoxy)acetamide
CID 19175983
2-(3-propan-2-ylphenoxy)-N-[2-(triazol-1-yl)phenyl]acetamide
CID 112835262
N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]-2-(3-propan-2-ylphenoxy)acetamide
CID 1191419
N-(2-chlorophenyl)-2-[3-(1-hydroxyethyl)phenoxy]acetamide
CID 43504310

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methylanilino)phenyl]-2-(3-propan-2-ylphenoxy)acetamide?
The IUPAC name of N-[2-(4-methylanilino)phenyl]-2-(3-propan-2-ylphenoxy)acetamide (CID 108745039) is N-[2-(4-methylanilino)phenyl]-2-(3-propan-2-ylphenoxy)acetamide.
What is the SMILES notation for N-[2-(4-methylanilino)phenyl]-2-(3-propan-2-ylphenoxy)acetamide?
The canonical SMILES for N-[2-(4-methylanilino)phenyl]-2-(3-propan-2-ylphenoxy)acetamide is Cc1ccc(Nc2ccccc2NC(=O)COc2cccc(C(C)C)c2)cc1.
What is the InChIKey of N-[2-(4-methylanilino)phenyl]-2-(3-propan-2-ylphenoxy)acetamide?
The InChIKey is OPZGQTWWJYMYQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O2/c1-17(2)19-7-6-8-21(15-19)28-16-24(27)26-23-10-5-4-9-22(23)25-20-13-11-18(3)12-14-20/h4-15,17,25H,16H2,1-3H3,(H,26,27).
What are the key properties of N-[2-(4-methylanilino)phenyl]-2-(3-propan-2-ylphenoxy)acetamide?
N-[2-(4-methylanilino)phenyl]-2-(3-propan-2-ylphenoxy)acetamide has a molecular weight of 374.48 g/mol, XLogP of 5.88, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methylanilino)phenyl]-2-(3-propan-2-ylphenoxy)acetamide is sourced from PubChem (CID 108745039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).