2-(4-propan-2-ylanilino)-N-(4-propan-2-ylphenyl)acetamide

C20H26N2O — CID 39448754

IUPAC2-(4-propan-2-ylanilino)-N-(4-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccc(NCC(=O)Nc2ccc(C(C)C)cc2)cc1
InChIInChI=1S/C20H26N2O/c1-14(2)16-5-9-18(10-6-16)21-13-20(23)22-19-11-7-17(8-12-19)15(3)4/h5-12,14-15,21H,13H2,1-4H3,(H,22,23)
InChIKeyXBHITXRJYUTSGE-UHFFFAOYSA-N
MW310.44 g/mol
LogP4.98
Rot. Bonds6

About 2-(4-propan-2-ylanilino)-N-(4-propan-2-ylphenyl)acetamide

2-(4-propan-2-ylanilino)-N-(4-propan-2-ylphenyl)acetamide (PubChem CID 39448754) has the molecular formula C20H26N2O and a molecular weight of 310.44 g/mol. Its IUPAC name is 2-(4-propan-2-ylanilino)-N-(4-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-propan-2-ylanilino)-N-(4-propan-2-ylphenyl)acetamide
PubChem CID39448754
Molecular FormulaC20H26N2O
Molecular Weight310.44 g/mol
Exact Mass310.20
IUPAC Name2-(4-propan-2-ylanilino)-N-(4-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccc(NCC(=O)Nc2ccc(C(C)C)cc2)cc1
InChIInChI=1S/C20H26N2O/c1-14(2)16-5-9-18(10-6-16)21-13-20(23)22-19-11-7-17(8-12-19)15(3)4/h5-12,14-15,21H,13H2,1-4H3,(H,22,23)
InChIKeyXBHITXRJYUTSGE-UHFFFAOYSA-N
XLogP4.98
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 54.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-ethoxyanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 39452982
N-(3-chloro-4-methylphenyl)-2-(4-propan-2-ylanilino)acetamide
CID 109007872
2-(2,6-dimethylanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 109007530
2-(methylamino)-N-(4-propan-2-ylphenyl)acetamide;hydrochloride
CID 119672801
2-acetamido-N-(4-propan-2-ylphenyl)acetamide
CID 110687041
N-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-propan-2-ylanilino)acetamide
CID 109007895
2-iodo-N-(4-propan-2-ylphenyl)acetamide
CID 60723215
ethane;1-(4-propan-2-ylanilino)propan-2-one
CID 143636599
2-[2-(dimethylamino)ethylamino]-N-(4-propan-2-ylphenyl)acetamide
CID 108994500
2-(4-chloro-2-methylanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 109007918
N-(4-bromo-2-methylphenyl)-2-(4-propan-2-ylanilino)acetamide
CID 99147022
3-amino-3-methyl-N-(4-propan-2-ylphenyl)butanamide
CID 64683934

Frequently Asked Questions

What is the IUPAC name of 2-(4-propan-2-ylanilino)-N-(4-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-(4-propan-2-ylanilino)-N-(4-propan-2-ylphenyl)acetamide (CID 39448754) is 2-(4-propan-2-ylanilino)-N-(4-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-(4-propan-2-ylanilino)-N-(4-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-(4-propan-2-ylanilino)-N-(4-propan-2-ylphenyl)acetamide is CC(C)c1ccc(NCC(=O)Nc2ccc(C(C)C)cc2)cc1.
What is the InChIKey of 2-(4-propan-2-ylanilino)-N-(4-propan-2-ylphenyl)acetamide?
The InChIKey is XBHITXRJYUTSGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O/c1-14(2)16-5-9-18(10-6-16)21-13-20(23)22-19-11-7-17(8-12-19)15(3)4/h5-12,14-15,21H,13H2,1-4H3,(H,22,23).
What are the key properties of 2-(4-propan-2-ylanilino)-N-(4-propan-2-ylphenyl)acetamide?
2-(4-propan-2-ylanilino)-N-(4-propan-2-ylphenyl)acetamide has a molecular weight of 310.44 g/mol, XLogP of 4.98, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-propan-2-ylanilino)-N-(4-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 39448754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).