2-(6-fluoroquinolin-2-yl)-N-(2-hydroxypropyl)acetamide

C14H15FN2O2 — CID 110490409

IUPAC2-(6-fluoroquinolin-2-yl)-N-(2-hydroxypropyl)acetamide
SMILESCC(O)CNC(=O)Cc1ccc2cc(F)ccc2n1
InChIInChI=1S/C14H15FN2O2/c1-9(18)8-16-14(19)7-12-4-2-10-6-11(15)3-5-13(10)17-12/h2-6,9,18H,7-8H2,1H3,(H,16,19)
InChIKeySPAXDLZQRYZYHW-UHFFFAOYSA-N
MW262.28 g/mol
LogP1.41
Rot. Bonds4

About 2-(6-fluoroquinolin-2-yl)-N-(2-hydroxypropyl)acetamide

2-(6-fluoroquinolin-2-yl)-N-(2-hydroxypropyl)acetamide (PubChem CID 110490409) has the molecular formula C14H15FN2O2 and a molecular weight of 262.28 g/mol. Its IUPAC name is 2-(6-fluoroquinolin-2-yl)-N-(2-hydroxypropyl)acetamide.

Molecular Properties

Compound Name2-(6-fluoroquinolin-2-yl)-N-(2-hydroxypropyl)acetamide
PubChem CID110490409
Molecular FormulaC14H15FN2O2
Molecular Weight262.28 g/mol
Exact Mass262.11
IUPAC Name2-(6-fluoroquinolin-2-yl)-N-(2-hydroxypropyl)acetamide
SMILESCC(O)CNC(=O)Cc1ccc2cc(F)ccc2n1
InChIInChI=1S/C14H15FN2O2/c1-9(18)8-16-14(19)7-12-4-2-10-6-11(15)3-5-13(10)17-12/h2-6,9,18H,7-8H2,1H3,(H,16,19)
InChIKeySPAXDLZQRYZYHW-UHFFFAOYSA-N
XLogP1.41
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.28
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(6-fluoroquinolin-2-yl)-N-(2-hydroxypropyl)acetamide?
The IUPAC name of 2-(6-fluoroquinolin-2-yl)-N-(2-hydroxypropyl)acetamide (CID 110490409) is 2-(6-fluoroquinolin-2-yl)-N-(2-hydroxypropyl)acetamide.
What is the SMILES notation for 2-(6-fluoroquinolin-2-yl)-N-(2-hydroxypropyl)acetamide?
The canonical SMILES for 2-(6-fluoroquinolin-2-yl)-N-(2-hydroxypropyl)acetamide is CC(O)CNC(=O)Cc1ccc2cc(F)ccc2n1.
What is the InChIKey of 2-(6-fluoroquinolin-2-yl)-N-(2-hydroxypropyl)acetamide?
The InChIKey is SPAXDLZQRYZYHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O2/c1-9(18)8-16-14(19)7-12-4-2-10-6-11(15)3-5-13(10)17-12/h2-6,9,18H,7-8H2,1H3,(H,16,19).
What are the key properties of 2-(6-fluoroquinolin-2-yl)-N-(2-hydroxypropyl)acetamide?
2-(6-fluoroquinolin-2-yl)-N-(2-hydroxypropyl)acetamide has a molecular weight of 262.28 g/mol, XLogP of 1.41, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoroquinolin-2-yl)-N-(2-hydroxypropyl)acetamide is sourced from PubChem (CID 110490409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).