2-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide

C22H28N2O4 — CID 113174308

IUPAC2-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccc(OC(C)C)cc1)c1ccccc1OC(C)C
InChIInChI=1S/C22H28N2O4/c1-15(2)27-19-12-10-18(11-13-19)23-22(26)14-24(17(5)25)20-8-6-7-9-21(20)28-16(3)4/h6-13,15-16H,14H2,1-5H3,(H,23,26)
InChIKeyNUPAERCMCDNMOA-UHFFFAOYSA-N
MW384.48 g/mol
LogP4.25
Rot. Bonds8

About 2-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide

2-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide (PubChem CID 113174308) has the molecular formula C22H28N2O4 and a molecular weight of 384.48 g/mol. Its IUPAC name is 2-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide
PubChem CID113174308
Molecular FormulaC22H28N2O4
Molecular Weight384.48 g/mol
Exact Mass384.20
IUPAC Name2-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccc(OC(C)C)cc1)c1ccccc1OC(C)C
InChIInChI=1S/C22H28N2O4/c1-15(2)27-19-12-10-18(11-13-19)23-22(26)14-24(17(5)25)20-8-6-7-9-21(20)28-16(3)4/h6-13,15-16H,14H2,1-5H3,(H,23,26)
InChIKeyNUPAERCMCDNMOA-UHFFFAOYSA-N
XLogP4.25
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-chlorophenyl)acetamide
CID 113174292
3-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)propanamide
CID 113129788
N-(3-acetylphenyl)-2-(N-acetyl-2-propan-2-yloxyanilino)acetamide
CID 113174315
2-(N-acetyl-2-propan-2-yloxyanilino)-N-(3-fluorophenyl)acetamide
CID 113174325
3-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-ethoxyphenyl)propanamide
CID 113129785
3-(N-acetyl-2-ethoxyanilino)-N-(4-propan-2-yloxyphenyl)propanamide
CID 113129331
2-(N-acetyl-2-propan-2-yloxyanilino)-N-(2-ethylphenyl)acetamide
CID 113174277
2-(N-acetyl-4-propan-2-yloxyanilino)-N-(4-fluorophenyl)acetamide
CID 113174445
2-(N-acetyl-5-chloro-2-methoxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 113172889
2-(N-acetyl-2-phenoxyanilino)-N-phenylacetamide
CID 113179233
3-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-tert-butylphenyl)propanamide
CID 113129770
2-(N-acetyl-4-chloroanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 113171603

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide?
The IUPAC name of 2-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide (CID 113174308) is 2-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide is CC(=O)N(CC(=O)Nc1ccc(OC(C)C)cc1)c1ccccc1OC(C)C.
What is the InChIKey of 2-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide?
The InChIKey is NUPAERCMCDNMOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O4/c1-15(2)27-19-12-10-18(11-13-19)23-22(26)14-24(17(5)25)20-8-6-7-9-21(20)28-16(3)4/h6-13,15-16H,14H2,1-5H3,(H,23,26).
What are the key properties of 2-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide?
2-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide has a molecular weight of 384.48 g/mol, XLogP of 4.25, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-2-propan-2-yloxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide is sourced from PubChem (CID 113174308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).