N-[4-ethoxy-6-(4-fluorophenyl)quinolin-2-yl]acetamide

C19H17FN2O2 — CID 110172120

IUPACN-[4-ethoxy-6-(4-fluorophenyl)quinolin-2-yl]acetamide
SMILESCCOc1cc(NC(C)=O)nc2ccc(-c3ccc(F)cc3)cc12
InChIInChI=1S/C19H17FN2O2/c1-3-24-18-11-19(21-12(2)23)22-17-9-6-14(10-16(17)18)13-4-7-15(20)8-5-13/h4-11H,3H2,1-2H3,(H,21,22,23)
InChIKeyFPGGGEBBHGNEJA-UHFFFAOYSA-N
MW324.36 g/mol
LogP4.40
Rot. Bonds4

About N-[4-ethoxy-6-(4-fluorophenyl)quinolin-2-yl]acetamide

N-[4-ethoxy-6-(4-fluorophenyl)quinolin-2-yl]acetamide (PubChem CID 110172120) has the molecular formula C19H17FN2O2 and a molecular weight of 324.36 g/mol. Its IUPAC name is N-[4-ethoxy-6-(4-fluorophenyl)quinolin-2-yl]acetamide.

Molecular Properties

Compound NameN-[4-ethoxy-6-(4-fluorophenyl)quinolin-2-yl]acetamide
PubChem CID110172120
Molecular FormulaC19H17FN2O2
Molecular Weight324.36 g/mol
Exact Mass324.13
IUPAC NameN-[4-ethoxy-6-(4-fluorophenyl)quinolin-2-yl]acetamide
SMILESCCOc1cc(NC(C)=O)nc2ccc(-c3ccc(F)cc3)cc12
InChIInChI=1S/C19H17FN2O2/c1-3-24-18-11-19(21-12(2)23)22-17-9-6-14(10-16(17)18)13-4-7-15(20)8-5-13/h4-11H,3H2,1-2H3,(H,21,22,23)
InChIKeyFPGGGEBBHGNEJA-UHFFFAOYSA-N
XLogP4.40
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.36
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-ethoxy-6-(4-fluorophenyl)quinolin-2-yl]acetamide?
The IUPAC name of N-[4-ethoxy-6-(4-fluorophenyl)quinolin-2-yl]acetamide (CID 110172120) is N-[4-ethoxy-6-(4-fluorophenyl)quinolin-2-yl]acetamide.
What is the SMILES notation for N-[4-ethoxy-6-(4-fluorophenyl)quinolin-2-yl]acetamide?
The canonical SMILES for N-[4-ethoxy-6-(4-fluorophenyl)quinolin-2-yl]acetamide is CCOc1cc(NC(C)=O)nc2ccc(-c3ccc(F)cc3)cc12.
What is the InChIKey of N-[4-ethoxy-6-(4-fluorophenyl)quinolin-2-yl]acetamide?
The InChIKey is FPGGGEBBHGNEJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN2O2/c1-3-24-18-11-19(21-12(2)23)22-17-9-6-14(10-16(17)18)13-4-7-15(20)8-5-13/h4-11H,3H2,1-2H3,(H,21,22,23).
What are the key properties of N-[4-ethoxy-6-(4-fluorophenyl)quinolin-2-yl]acetamide?
N-[4-ethoxy-6-(4-fluorophenyl)quinolin-2-yl]acetamide has a molecular weight of 324.36 g/mol, XLogP of 4.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-ethoxy-6-(4-fluorophenyl)quinolin-2-yl]acetamide is sourced from PubChem (CID 110172120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).