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

C13H20N2O2 — CID 65176145

IUPACN-[4-(3-ethoxypropylamino)phenyl]acetamide
SMILESCCOCCCNc1ccc(NC(C)=O)cc1
InChIInChI=1S/C13H20N2O2/c1-3-17-10-4-9-14-12-5-7-13(8-6-12)15-11(2)16/h5-8,14H,3-4,9-10H2,1-2H3,(H,15,16)
InChIKeyMWEROZJTBJYPQF-UHFFFAOYSA-N
MW236.31 g/mol
LogP2.48
Rot. Bonds7

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

N-[4-(3-ethoxypropylamino)phenyl]acetamide (PubChem CID 65176145) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is N-[4-(3-ethoxypropylamino)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(3-ethoxypropylamino)phenyl]acetamide
PubChem CID65176145
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC NameN-[4-(3-ethoxypropylamino)phenyl]acetamide
SMILESCCOCCCNc1ccc(NC(C)=O)cc1
InChIInChI=1S/C13H20N2O2/c1-3-17-10-4-9-14-12-5-7-13(8-6-12)15-11(2)16/h5-8,14H,3-4,9-10H2,1-2H3,(H,15,16)
InChIKeyMWEROZJTBJYPQF-UHFFFAOYSA-N
XLogP2.48
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 52.48
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-(2,2,2-trifluoroethoxy)propylamino]phenyl]acetamide
CID 61491158
1-[4-(3-ethoxypropylamino)phenyl]propan-1-one
CID 114066648
N-(3-ethoxypropyl)-4-methylaniline
CID 65176643
N-[4-(3-phenoxypropylamino)phenyl]acetamide
CID 60678376
4-bromo-N-(3-ethoxypropyl)aniline
CID 65176368
N-[4-[2-(3-ethoxypropylamino)-5-methyl-1,3-thiazol-4-yl]phenyl]acetamide
CID 9232326
4-ethoxy-N-(3-ethoxypropyl)aniline
CID 65176310
N-[4-(2-(113C)ethoxyethoxy)phenyl]acetamide
CID 54301804
N-(3-ethoxypropyl)-4-(trifluoromethyl)aniline
CID 62648259
N-[4-[2-[[N-(3-ethoxypropyl)-N'-methylcarbamimidoyl]amino]ethyl]phenyl]acetamide;hydroiodide
CID 111221838
1-(4-aminophenyl)-3-(3-ethoxypropyl)urea
CID 43469047
4-(difluoromethylsulfonyl)-N-(3-ethoxypropyl)aniline
CID 43455318

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-ethoxypropylamino)phenyl]acetamide?
The IUPAC name of N-[4-(3-ethoxypropylamino)phenyl]acetamide (CID 65176145) is N-[4-(3-ethoxypropylamino)phenyl]acetamide.
What is the SMILES notation for N-[4-(3-ethoxypropylamino)phenyl]acetamide?
The canonical SMILES for N-[4-(3-ethoxypropylamino)phenyl]acetamide is CCOCCCNc1ccc(NC(C)=O)cc1.
What is the InChIKey of N-[4-(3-ethoxypropylamino)phenyl]acetamide?
The InChIKey is MWEROZJTBJYPQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-3-17-10-4-9-14-12-5-7-13(8-6-12)15-11(2)16/h5-8,14H,3-4,9-10H2,1-2H3,(H,15,16).
What are the key properties of N-[4-(3-ethoxypropylamino)phenyl]acetamide?
N-[4-(3-ethoxypropylamino)phenyl]acetamide has a molecular weight of 236.31 g/mol, XLogP of 2.48, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-ethoxypropylamino)phenyl]acetamide is sourced from PubChem (CID 65176145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).