2-[4-(dimethylamino)anilino]-N-(4-phenylmethoxyphenyl)acetamide

C23H25N3O2 — CID 109010303

IUPAC2-[4-(dimethylamino)anilino]-N-(4-phenylmethoxyphenyl)acetamide
SMILESCN(C)c1ccc(NCC(=O)Nc2ccc(OCc3ccccc3)cc2)cc1
InChIInChI=1S/C23H25N3O2/c1-26(2)21-12-8-19(9-13-21)24-16-23(27)25-20-10-14-22(15-11-20)28-17-18-6-4-3-5-7-18/h3-15,24H,16-17H2,1-2H3,(H,25,27)
InChIKeyFPWQQOSHJFUECK-UHFFFAOYSA-N
MW375.47 g/mol
LogP4.38
Rot. Bonds8

About 2-[4-(dimethylamino)anilino]-N-(4-phenylmethoxyphenyl)acetamide

2-[4-(dimethylamino)anilino]-N-(4-phenylmethoxyphenyl)acetamide (PubChem CID 109010303) has the molecular formula C23H25N3O2 and a molecular weight of 375.47 g/mol. Its IUPAC name is 2-[4-(dimethylamino)anilino]-N-(4-phenylmethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[4-(dimethylamino)anilino]-N-(4-phenylmethoxyphenyl)acetamide
PubChem CID109010303
Molecular FormulaC23H25N3O2
Molecular Weight375.47 g/mol
Exact Mass375.19
IUPAC Name2-[4-(dimethylamino)anilino]-N-(4-phenylmethoxyphenyl)acetamide
SMILESCN(C)c1ccc(NCC(=O)Nc2ccc(OCc3ccccc3)cc2)cc1
InChIInChI=1S/C23H25N3O2/c1-26(2)21-12-8-19(9-13-21)24-16-23(27)25-20-10-14-22(15-11-20)28-17-18-6-4-3-5-7-18/h3-15,24H,16-17H2,1-2H3,(H,25,27)
InChIKeyFPWQQOSHJFUECK-UHFFFAOYSA-N
XLogP4.38
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

N-[4-[acetyl(methyl)amino]phenyl]-2-(4-phenylmethoxyanilino)acetamide
CID 54821839
N-[4-[[2-(4-phenylmethoxyanilino)acetyl]amino]phenyl]butanamide
CID 54821938
4-[[2-oxo-2-(4-phenylmethoxyanilino)ethyl]amino]-N,N-dipropylbenzamide
CID 54832179
N,N-diethyl-4-[[2-(4-phenylmethoxyanilino)acetyl]amino]benzamide
CID 37221073
[2-[4-(dimethylamino)anilino]-2-oxoethyl] 4-phenylmethoxybenzoate
CID 7149521
2-[2-(dimethylamino)ethylamino]-N-(4-phenylmethoxyphenyl)acetamide
CID 108994541
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-[4-(2-phenoxyethoxy)anilino]-N-[4-(2-phenoxyethoxy)phenyl]acetamide
CID 54823077
N-[4-(dimethylamino)phenyl]-2-(4-phenylmethoxyanilino)propanamide
CID 154774074
3-methyl-N-[4-[[2-oxo-2-(4-phenylmethoxyanilino)ethyl]amino]phenyl]benzamide
CID 54840284
propyl 4-[[2-(4-phenylmethoxyanilino)acetyl]amino]benzoate
CID 54822023

Frequently Asked Questions

What is the IUPAC name of 2-[4-(dimethylamino)anilino]-N-(4-phenylmethoxyphenyl)acetamide?
The IUPAC name of 2-[4-(dimethylamino)anilino]-N-(4-phenylmethoxyphenyl)acetamide (CID 109010303) is 2-[4-(dimethylamino)anilino]-N-(4-phenylmethoxyphenyl)acetamide.
What is the SMILES notation for 2-[4-(dimethylamino)anilino]-N-(4-phenylmethoxyphenyl)acetamide?
The canonical SMILES for 2-[4-(dimethylamino)anilino]-N-(4-phenylmethoxyphenyl)acetamide is CN(C)c1ccc(NCC(=O)Nc2ccc(OCc3ccccc3)cc2)cc1.
What is the InChIKey of 2-[4-(dimethylamino)anilino]-N-(4-phenylmethoxyphenyl)acetamide?
The InChIKey is FPWQQOSHJFUECK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O2/c1-26(2)21-12-8-19(9-13-21)24-16-23(27)25-20-10-14-22(15-11-20)28-17-18-6-4-3-5-7-18/h3-15,24H,16-17H2,1-2H3,(H,25,27).
What are the key properties of 2-[4-(dimethylamino)anilino]-N-(4-phenylmethoxyphenyl)acetamide?
2-[4-(dimethylamino)anilino]-N-(4-phenylmethoxyphenyl)acetamide has a molecular weight of 375.47 g/mol, XLogP of 4.38, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(dimethylamino)anilino]-N-(4-phenylmethoxyphenyl)acetamide is sourced from PubChem (CID 109010303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).