N-[3-(furan-2-yl)propyl]-2-(4-methylphenyl)acetamide

C16H19NO2 — CID 53283761

IUPACN-[3-(furan-2-yl)propyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)NCCCc2ccco2)cc1
InChIInChI=1S/C16H19NO2/c1-13-6-8-14(9-7-13)12-16(18)17-10-2-4-15-5-3-11-19-15/h3,5-9,11H,2,4,10,12H2,1H3,(H,17,18)
InChIKeyLNTDPECJMDAMJK-UHFFFAOYSA-N
MW257.33 g/mol
LogP2.88
Rot. Bonds6

About N-[3-(furan-2-yl)propyl]-2-(4-methylphenyl)acetamide

N-[3-(furan-2-yl)propyl]-2-(4-methylphenyl)acetamide (PubChem CID 53283761) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is N-[3-(furan-2-yl)propyl]-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[3-(furan-2-yl)propyl]-2-(4-methylphenyl)acetamide
PubChem CID53283761
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC NameN-[3-(furan-2-yl)propyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)NCCCc2ccco2)cc1
InChIInChI=1S/C16H19NO2/c1-13-6-8-14(9-7-13)12-16(18)17-10-2-4-15-5-3-11-19-15/h3,5-9,11H,2,4,10,12H2,1H3,(H,17,18)
InChIKeyLNTDPECJMDAMJK-UHFFFAOYSA-N
XLogP2.88
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(2,4-dimethylphenyl)-N-[3-(furan-2-yl)propyl]acetamide
CID 100597098
N-[3-(furan-2-yl)propyl]-2,5-dimethylbenzamide
CID 100623229
N-[2-[acetyl(furan-2-ylmethyl)amino]ethyl]-2-(4-methylphenyl)acetamide
CID 113053917
2-(2-fluorophenyl)-N-[3-(furan-2-yl)propyl]acetamide
CID 100637712
N-[2-(furan-2-yl)ethyl]-4-methylbenzamide
CID 5305680
1-(furan-2-yl)-3-(4-methylphenyl)propan-2-one
CID 83172579
N-[2-(furan-2-yl)ethyl]-2-(4-methylphenoxy)acetamide
CID 110733528
N-[3-(4-fluorophenyl)propyl]-2-(4-methylphenyl)acetamide
CID 92684324
N-[3-(4-chlorophenyl)propyl]-2-(4-methylphenyl)acetamide
CID 38019898
2-(4-fluorophenyl)-N-[3-(4-methylphenyl)propyl]acetamide
CID 100706292
N-[3-(furan-2-yl)propyl]-2-[3-(4-methylphenyl)-6-oxopyridazin-1-yl]acetamide
CID 56643056
N-[3-(furan-2-yl)propyl]-6-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 66497528

Frequently Asked Questions

What is the IUPAC name of N-[3-(furan-2-yl)propyl]-2-(4-methylphenyl)acetamide?
The IUPAC name of N-[3-(furan-2-yl)propyl]-2-(4-methylphenyl)acetamide (CID 53283761) is N-[3-(furan-2-yl)propyl]-2-(4-methylphenyl)acetamide.
What is the SMILES notation for N-[3-(furan-2-yl)propyl]-2-(4-methylphenyl)acetamide?
The canonical SMILES for N-[3-(furan-2-yl)propyl]-2-(4-methylphenyl)acetamide is Cc1ccc(CC(=O)NCCCc2ccco2)cc1.
What is the InChIKey of N-[3-(furan-2-yl)propyl]-2-(4-methylphenyl)acetamide?
The InChIKey is LNTDPECJMDAMJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-13-6-8-14(9-7-13)12-16(18)17-10-2-4-15-5-3-11-19-15/h3,5-9,11H,2,4,10,12H2,1H3,(H,17,18).
What are the key properties of N-[3-(furan-2-yl)propyl]-2-(4-methylphenyl)acetamide?
N-[3-(furan-2-yl)propyl]-2-(4-methylphenyl)acetamide has a molecular weight of 257.33 g/mol, XLogP of 2.88, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(furan-2-yl)propyl]-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 53283761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).