2-(N-acetyl-4-propan-2-ylanilino)-N-phenylacetamide

C19H22N2O2 — CID 113169827

IUPAC2-(N-acetyl-4-propan-2-ylanilino)-N-phenylacetamide
SMILESCC(=O)N(CC(=O)Nc1ccccc1)c1ccc(C(C)C)cc1
InChIInChI=1S/C19H22N2O2/c1-14(2)16-9-11-18(12-10-16)21(15(3)22)13-19(23)20-17-7-5-4-6-8-17/h4-12,14H,13H2,1-3H3,(H,20,23)
InChIKeyUHVQZJBXSDGTCC-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.80
Rot. Bonds5

About 2-(N-acetyl-4-propan-2-ylanilino)-N-phenylacetamide

2-(N-acetyl-4-propan-2-ylanilino)-N-phenylacetamide (PubChem CID 113169827) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 2-(N-acetyl-4-propan-2-ylanilino)-N-phenylacetamide.

Molecular Properties

Compound Name2-(N-acetyl-4-propan-2-ylanilino)-N-phenylacetamide
PubChem CID113169827
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name2-(N-acetyl-4-propan-2-ylanilino)-N-phenylacetamide
SMILESCC(=O)N(CC(=O)Nc1ccccc1)c1ccc(C(C)C)cc1
InChIInChI=1S/C19H22N2O2/c1-14(2)16-9-11-18(12-10-16)21(15(3)22)13-19(23)20-17-7-5-4-6-8-17/h4-12,14H,13H2,1-3H3,(H,20,23)
InChIKeyUHVQZJBXSDGTCC-UHFFFAOYSA-N
XLogP3.80
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-acetamido-N-acetylanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 113175968
2-(N-acetyl-4-ethylanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 113169312
2-(N-acetyl-4-methoxyanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 113173591
2-(N-acetyl-4-propan-2-ylanilino)-N-(2-methylphenyl)acetamide
CID 113169828
methyl 3-[[2-(N-acetyl-4-propan-2-ylanilino)acetyl]amino]benzoate
CID 113169884
3-(N-acetylanilino)-N-(4-propan-2-ylphenyl)propanamide
CID 113123440
2-(N-acetyl-3-bromoanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 113177946
2-(N-acetyl-3-fluoroanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 113177670
2-(N-acetyl-3,4-dichloroanilino)-N-phenylacetamide
CID 113179470
2-[acetyl(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-N-(4-propan-2-ylphenyl)acetamide
CID 113178476
2-(N-acetyl-4-pyrrolidin-1-ylanilino)-N-phenylacetamide
CID 113177016
2-(N-acetyl-4-propan-2-ylanilino)-N-propylacetamide
CID 113169744

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-4-propan-2-ylanilino)-N-phenylacetamide?
The IUPAC name of 2-(N-acetyl-4-propan-2-ylanilino)-N-phenylacetamide (CID 113169827) is 2-(N-acetyl-4-propan-2-ylanilino)-N-phenylacetamide.
What is the SMILES notation for 2-(N-acetyl-4-propan-2-ylanilino)-N-phenylacetamide?
The canonical SMILES for 2-(N-acetyl-4-propan-2-ylanilino)-N-phenylacetamide is CC(=O)N(CC(=O)Nc1ccccc1)c1ccc(C(C)C)cc1.
What is the InChIKey of 2-(N-acetyl-4-propan-2-ylanilino)-N-phenylacetamide?
The InChIKey is UHVQZJBXSDGTCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-14(2)16-9-11-18(12-10-16)21(15(3)22)13-19(23)20-17-7-5-4-6-8-17/h4-12,14H,13H2,1-3H3,(H,20,23).
What are the key properties of 2-(N-acetyl-4-propan-2-ylanilino)-N-phenylacetamide?
2-(N-acetyl-4-propan-2-ylanilino)-N-phenylacetamide has a molecular weight of 310.40 g/mol, XLogP of 3.80, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-4-propan-2-ylanilino)-N-phenylacetamide is sourced from PubChem (CID 113169827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).