N-[4-(3-methoxypropylamino)phenyl]-2-(4-methylphenyl)acetamide

C19H24N2O2 — CID 112981081

IUPACN-[4-(3-methoxypropylamino)phenyl]-2-(4-methylphenyl)acetamide
SMILESCOCCCNc1ccc(NC(=O)Cc2ccc(C)cc2)cc1
InChIInChI=1S/C19H24N2O2/c1-15-4-6-16(7-5-15)14-19(22)21-18-10-8-17(9-11-18)20-12-3-13-23-2/h4-11,20H,3,12-14H2,1-2H3,(H,21,22)
InChIKeyJFAUQUHCWRWSDW-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.62
Rot. Bonds8

About N-[4-(3-methoxypropylamino)phenyl]-2-(4-methylphenyl)acetamide

N-[4-(3-methoxypropylamino)phenyl]-2-(4-methylphenyl)acetamide (PubChem CID 112981081) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is N-[4-(3-methoxypropylamino)phenyl]-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[4-(3-methoxypropylamino)phenyl]-2-(4-methylphenyl)acetamide
PubChem CID112981081
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC NameN-[4-(3-methoxypropylamino)phenyl]-2-(4-methylphenyl)acetamide
SMILESCOCCCNc1ccc(NC(=O)Cc2ccc(C)cc2)cc1
InChIInChI=1S/C19H24N2O2/c1-15-4-6-16(7-5-15)14-19(22)21-18-10-8-17(9-11-18)20-12-3-13-23-2/h4-11,20H,3,12-14H2,1-2H3,(H,21,22)
InChIKeyJFAUQUHCWRWSDW-UHFFFAOYSA-N
XLogP3.62
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[4-(3-methylbutylamino)phenyl]-2-(4-methylphenyl)acetamide
CID 112985122
N-(4-fluorophenyl)-2-(4-methylphenyl)acetamide
CID 889367
5-(3-methoxypropylamino)-N-(4-methylphenyl)pyridine-3-carboxamide
CID 109228264
N-(4-methylphenyl)-2-[4-[(2-methylpropan-2-yl)oxy]phenyl]acetamide
CID 110437429
N-[4-(3-methoxypropylamino)phenyl]benzamide
CID 112981031
N-[4-(2-hydrazinyl-2-oxoethyl)phenyl]-2-(4-methylphenyl)acetamide
CID 155375566
N-[4-(aminomethyl)phenyl]-2-(4-methylphenyl)acetamide
CID 43152378
2-(4-aminophenyl)-N-(4-methylphenyl)acetamide
CID 16782162
2-(4-bromophenyl)-N-[4-(3-methoxypropylsulfamoyl)phenyl]acetamide
CID 17256718
2-[4-(difluoromethoxy)phenyl]-N-(4-methylphenyl)acetamide
CID 33142215
2-(4-methoxyphenyl)-N-(4-methylphenyl)acetamide;methyl 2-(4-methoxyphenyl)acetate
CID 161099806
methyl 4-[4-[[2-(4-methylphenyl)acetyl]amino]anilino]benzoate
CID 112988583

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-methoxypropylamino)phenyl]-2-(4-methylphenyl)acetamide?
The IUPAC name of N-[4-(3-methoxypropylamino)phenyl]-2-(4-methylphenyl)acetamide (CID 112981081) is N-[4-(3-methoxypropylamino)phenyl]-2-(4-methylphenyl)acetamide.
What is the SMILES notation for N-[4-(3-methoxypropylamino)phenyl]-2-(4-methylphenyl)acetamide?
The canonical SMILES for N-[4-(3-methoxypropylamino)phenyl]-2-(4-methylphenyl)acetamide is COCCCNc1ccc(NC(=O)Cc2ccc(C)cc2)cc1.
What is the InChIKey of N-[4-(3-methoxypropylamino)phenyl]-2-(4-methylphenyl)acetamide?
The InChIKey is JFAUQUHCWRWSDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-15-4-6-16(7-5-15)14-19(22)21-18-10-8-17(9-11-18)20-12-3-13-23-2/h4-11,20H,3,12-14H2,1-2H3,(H,21,22).
What are the key properties of N-[4-(3-methoxypropylamino)phenyl]-2-(4-methylphenyl)acetamide?
N-[4-(3-methoxypropylamino)phenyl]-2-(4-methylphenyl)acetamide has a molecular weight of 312.41 g/mol, XLogP of 3.62, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-methoxypropylamino)phenyl]-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 112981081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).