N-(4-fluoro-2-methoxyphenyl)-2-(2-oxopiperidin-1-yl)acetamide

C14H17FN2O3 — CID 78864389

IUPACN-(4-fluoro-2-methoxyphenyl)-2-(2-oxopiperidin-1-yl)acetamide
SMILESCOc1cc(F)ccc1NC(=O)CN1CCCCC1=O
InChIInChI=1S/C14H17FN2O3/c1-20-12-8-10(15)5-6-11(12)16-13(18)9-17-7-3-2-4-14(17)19/h5-6,8H,2-4,7,9H2,1H3,(H,16,18)
InChIKeyQCVGDBLZEGIVNI-UHFFFAOYSA-N
MW280.30 g/mol
LogP1.79
Rot. Bonds4

About N-(4-fluoro-2-methoxyphenyl)-2-(2-oxopiperidin-1-yl)acetamide

N-(4-fluoro-2-methoxyphenyl)-2-(2-oxopiperidin-1-yl)acetamide (PubChem CID 78864389) has the molecular formula C14H17FN2O3 and a molecular weight of 280.30 g/mol. Its IUPAC name is N-(4-fluoro-2-methoxyphenyl)-2-(2-oxopiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-fluoro-2-methoxyphenyl)-2-(2-oxopiperidin-1-yl)acetamide
PubChem CID78864389
Molecular FormulaC14H17FN2O3
Molecular Weight280.30 g/mol
Exact Mass280.12
IUPAC NameN-(4-fluoro-2-methoxyphenyl)-2-(2-oxopiperidin-1-yl)acetamide
SMILESCOc1cc(F)ccc1NC(=O)CN1CCCCC1=O
InChIInChI=1S/C14H17FN2O3/c1-20-12-8-10(15)5-6-11(12)16-13(18)9-17-7-3-2-4-14(17)19/h5-6,8H,2-4,7,9H2,1H3,(H,16,18)
InChIKeyQCVGDBLZEGIVNI-UHFFFAOYSA-N
XLogP1.79
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.30
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-2-methoxyphenyl)-2-(2-oxopiperidin-1-yl)acetamide?
The IUPAC name of N-(4-fluoro-2-methoxyphenyl)-2-(2-oxopiperidin-1-yl)acetamide (CID 78864389) is N-(4-fluoro-2-methoxyphenyl)-2-(2-oxopiperidin-1-yl)acetamide.
What is the SMILES notation for N-(4-fluoro-2-methoxyphenyl)-2-(2-oxopiperidin-1-yl)acetamide?
The canonical SMILES for N-(4-fluoro-2-methoxyphenyl)-2-(2-oxopiperidin-1-yl)acetamide is COc1cc(F)ccc1NC(=O)CN1CCCCC1=O.
What is the InChIKey of N-(4-fluoro-2-methoxyphenyl)-2-(2-oxopiperidin-1-yl)acetamide?
The InChIKey is QCVGDBLZEGIVNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN2O3/c1-20-12-8-10(15)5-6-11(12)16-13(18)9-17-7-3-2-4-14(17)19/h5-6,8H,2-4,7,9H2,1H3,(H,16,18).
What are the key properties of N-(4-fluoro-2-methoxyphenyl)-2-(2-oxopiperidin-1-yl)acetamide?
N-(4-fluoro-2-methoxyphenyl)-2-(2-oxopiperidin-1-yl)acetamide has a molecular weight of 280.30 g/mol, XLogP of 1.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-2-methoxyphenyl)-2-(2-oxopiperidin-1-yl)acetamide is sourced from PubChem (CID 78864389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).