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

C24H26N2O2 — CID 37221138

IUPAC2-(4-phenylmethoxyanilino)-N-(2-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccccc1NC(=O)CNc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C24H26N2O2/c1-18(2)22-10-6-7-11-23(22)26-24(27)16-25-20-12-14-21(15-13-20)28-17-19-8-4-3-5-9-19/h3-15,18,25H,16-17H2,1-2H3,(H,26,27)
InChIKeyQKXGRTCQPCDELK-UHFFFAOYSA-N
MW374.48 g/mol
LogP5.44
Rot. Bonds8

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

2-(4-phenylmethoxyanilino)-N-(2-propan-2-ylphenyl)acetamide (PubChem CID 37221138) has the molecular formula C24H26N2O2 and a molecular weight of 374.48 g/mol. Its IUPAC name is 2-(4-phenylmethoxyanilino)-N-(2-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-phenylmethoxyanilino)-N-(2-propan-2-ylphenyl)acetamide
PubChem CID37221138
Molecular FormulaC24H26N2O2
Molecular Weight374.48 g/mol
Exact Mass374.20
IUPAC Name2-(4-phenylmethoxyanilino)-N-(2-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccccc1NC(=O)CNc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C24H26N2O2/c1-18(2)22-10-6-7-11-23(22)26-24(27)16-25-20-12-14-21(15-13-20)28-17-19-8-4-3-5-9-19/h3-15,18,25H,16-17H2,1-2H3,(H,26,27)
InChIKeyQKXGRTCQPCDELK-UHFFFAOYSA-N
XLogP5.44
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.48
LogP ≤ 55.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

N-naphthalen-2-yl-2-(4-phenylmethoxyanilino)acetamide
CID 54821756
4-[[2-oxo-2-(4-phenylmethoxyanilino)ethyl]amino]-N-propan-2-ylbenzamide
CID 54840386
2-(naphthalen-2-ylamino)-N-(2-propan-2-ylphenyl)acetamide
CID 26506452
2-[2-(2-methylpropoxy)anilino]-N-(4-phenylmethoxyphenyl)acetamide
CID 54824046
N-[4-[[2-(4-phenylmethoxyanilino)acetyl]amino]phenyl]butanamide
CID 54821938
2-(4-phenylmethoxyanilino)-N-quinolin-8-ylacetamide
CID 109010747
2-[4-(dimethylamino)anilino]-N-(4-phenylmethoxyphenyl)acetamide
CID 109010303
N-(2,4-difluorophenyl)-2-(4-phenylmethoxyanilino)acetamide
CID 37220850
4-[[2-oxo-2-(4-phenylmethoxyanilino)ethyl]amino]-N-(1-phenylethyl)benzamide
CID 54846404
2-phenoxy-N-(2-propan-2-ylphenyl)acetamide
CID 723304
3-methyl-N-[4-[[2-oxo-2-(4-phenylmethoxyanilino)ethyl]amino]phenyl]benzamide
CID 54840284
ethyl 2-(4-phenylmethoxyanilino)acetate
CID 3652798

Frequently Asked Questions

What is the IUPAC name of 2-(4-phenylmethoxyanilino)-N-(2-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-(4-phenylmethoxyanilino)-N-(2-propan-2-ylphenyl)acetamide (CID 37221138) is 2-(4-phenylmethoxyanilino)-N-(2-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-(4-phenylmethoxyanilino)-N-(2-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-(4-phenylmethoxyanilino)-N-(2-propan-2-ylphenyl)acetamide is CC(C)c1ccccc1NC(=O)CNc1ccc(OCc2ccccc2)cc1.
What is the InChIKey of 2-(4-phenylmethoxyanilino)-N-(2-propan-2-ylphenyl)acetamide?
The InChIKey is QKXGRTCQPCDELK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O2/c1-18(2)22-10-6-7-11-23(22)26-24(27)16-25-20-12-14-21(15-13-20)28-17-19-8-4-3-5-9-19/h3-15,18,25H,16-17H2,1-2H3,(H,26,27).
What are the key properties of 2-(4-phenylmethoxyanilino)-N-(2-propan-2-ylphenyl)acetamide?
2-(4-phenylmethoxyanilino)-N-(2-propan-2-ylphenyl)acetamide has a molecular weight of 374.48 g/mol, XLogP of 5.44, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenylmethoxyanilino)-N-(2-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 37221138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).