N-[4-(3-phenoxypropylamino)phenyl]acetamide

C17H20N2O2 — CID 60678376

IUPACN-[4-(3-phenoxypropylamino)phenyl]acetamide
SMILESCC(=O)Nc1ccc(NCCCOc2ccccc2)cc1
InChIInChI=1S/C17H20N2O2/c1-14(20)19-16-10-8-15(9-11-16)18-12-5-13-21-17-6-3-2-4-7-17/h2-4,6-11,18H,5,12-13H2,1H3,(H,19,20)
InChIKeyBRWHXLGPZVONSR-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.53
Rot. Bonds7

About N-[4-(3-phenoxypropylamino)phenyl]acetamide

N-[4-(3-phenoxypropylamino)phenyl]acetamide (PubChem CID 60678376) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-[4-(3-phenoxypropylamino)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(3-phenoxypropylamino)phenyl]acetamide
PubChem CID60678376
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-[4-(3-phenoxypropylamino)phenyl]acetamide
SMILESCC(=O)Nc1ccc(NCCCOc2ccccc2)cc1
InChIInChI=1S/C17H20N2O2/c1-14(20)19-16-10-8-15(9-11-16)18-12-5-13-21-17-6-3-2-4-7-17/h2-4,6-11,18H,5,12-13H2,1H3,(H,19,20)
InChIKeyBRWHXLGPZVONSR-UHFFFAOYSA-N
XLogP3.53
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.53
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

4-(3-phenoxypropylamino)benzamide
CID 60678988
N-[4-(3-ethoxypropylamino)phenyl]acetamide
CID 65176145
N-[4-(4-phenylbutoxy)phenyl]acetamide
CID 143188438
N-(4-acetamidophenyl)-2-phenoxyacetamide
CID 675023
2-methyl-4-(3-phenoxypropylamino)benzoic acid
CID 81273769
N-[3-(3-phenoxypropylcarbamoylamino)phenyl]acetamide
CID 108883171
N-(4-acetamidophenyl)-2-[4-(3-phenylpropoxy)anilino]acetamide
CID 54825334
N-[4-(3-chloropropoxy)phenyl]acetamide
CID 5147668
2-acetyloxy-5-(3-phenoxypropylamino)benzoic acid
CID 69401994
4-[4-(2-phenoxyethoxy)anilino]butan-1-ol
CID 54803419
N-[4-[2-(ethylamino)ethoxy]phenyl]acetamide
CID 103074267
N-[4-[3-(2,2,2-trifluoroethoxy)propylamino]phenyl]acetamide
CID 61491158

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-phenoxypropylamino)phenyl]acetamide?
The IUPAC name of N-[4-(3-phenoxypropylamino)phenyl]acetamide (CID 60678376) is N-[4-(3-phenoxypropylamino)phenyl]acetamide.
What is the SMILES notation for N-[4-(3-phenoxypropylamino)phenyl]acetamide?
The canonical SMILES for N-[4-(3-phenoxypropylamino)phenyl]acetamide is CC(=O)Nc1ccc(NCCCOc2ccccc2)cc1.
What is the InChIKey of N-[4-(3-phenoxypropylamino)phenyl]acetamide?
The InChIKey is BRWHXLGPZVONSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-14(20)19-16-10-8-15(9-11-16)18-12-5-13-21-17-6-3-2-4-7-17/h2-4,6-11,18H,5,12-13H2,1H3,(H,19,20).
What are the key properties of N-[4-(3-phenoxypropylamino)phenyl]acetamide?
N-[4-(3-phenoxypropylamino)phenyl]acetamide has a molecular weight of 284.36 g/mol, XLogP of 3.53, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-phenoxypropylamino)phenyl]acetamide is sourced from PubChem (CID 60678376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).