N-[1-[4-(2-ethoxy-3-pyridinyl)phenyl]ethyl]acetamide

C17H20N2O2 — CID 56706704

IUPACN-[1-[4-(2-ethoxy-3-pyridinyl)phenyl]ethyl]acetamide
SMILESCCOc1ncccc1-c1ccc(C(C)NC(C)=O)cc1
InChIInChI=1S/C17H20N2O2/c1-4-21-17-16(6-5-11-18-17)15-9-7-14(8-10-15)12(2)19-13(3)20/h5-12H,4H2,1-3H3,(H,19,20)
InChIKeyKTMXKVLPQJDDCS-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.34
Rot. Bonds5

About N-[1-[4-(2-ethoxy-3-pyridinyl)phenyl]ethyl]acetamide

N-[1-[4-(2-ethoxy-3-pyridinyl)phenyl]ethyl]acetamide (PubChem CID 56706704) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-[1-[4-(2-ethoxy-3-pyridinyl)phenyl]ethyl]acetamide.

Molecular Properties

Compound NameN-[1-[4-(2-ethoxy-3-pyridinyl)phenyl]ethyl]acetamide
PubChem CID56706704
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-[1-[4-(2-ethoxy-3-pyridinyl)phenyl]ethyl]acetamide
SMILESCCOc1ncccc1-c1ccc(C(C)NC(C)=O)cc1
InChIInChI=1S/C17H20N2O2/c1-4-21-17-16(6-5-11-18-17)15-9-7-14(8-10-15)12(2)19-13(3)20/h5-12H,4H2,1-3H3,(H,19,20)
InChIKeyKTMXKVLPQJDDCS-UHFFFAOYSA-N
XLogP3.34
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[1-[4-(2-ethoxy-3-pyridinyl)phenyl]ethyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[1-[4-(2-ethoxy-3-pyridinyl)phenyl]ethyl]acetamide?
The IUPAC name of N-[1-[4-(2-ethoxy-3-pyridinyl)phenyl]ethyl]acetamide (CID 56706704) is N-[1-[4-(2-ethoxy-3-pyridinyl)phenyl]ethyl]acetamide.
What is the SMILES notation for N-[1-[4-(2-ethoxy-3-pyridinyl)phenyl]ethyl]acetamide?
The canonical SMILES for N-[1-[4-(2-ethoxy-3-pyridinyl)phenyl]ethyl]acetamide is CCOc1ncccc1-c1ccc(C(C)NC(C)=O)cc1.
What is the InChIKey of N-[1-[4-(2-ethoxy-3-pyridinyl)phenyl]ethyl]acetamide?
The InChIKey is KTMXKVLPQJDDCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-4-21-17-16(6-5-11-18-17)15-9-7-14(8-10-15)12(2)19-13(3)20/h5-12H,4H2,1-3H3,(H,19,20).
What are the key properties of N-[1-[4-(2-ethoxy-3-pyridinyl)phenyl]ethyl]acetamide?
N-[1-[4-(2-ethoxy-3-pyridinyl)phenyl]ethyl]acetamide has a molecular weight of 284.36 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[4-(2-ethoxy-3-pyridinyl)phenyl]ethyl]acetamide is sourced from PubChem (CID 56706704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).