N-[[2-(4-fluorophenyl)-3-pyridinyl]methyl]oxolane-2-carboxamide

C17H17FN2O2 — CID 53148241

IUPACN-[[2-(4-fluorophenyl)-3-pyridinyl]methyl]oxolane-2-carboxamide
SMILESO=C(NCc1cccnc1-c1ccc(F)cc1)C1CCCO1
InChIInChI=1S/C17H17FN2O2/c18-14-7-5-12(6-8-14)16-13(3-1-9-19-16)11-20-17(21)15-4-2-10-22-15/h1,3,5-9,15H,2,4,10-11H2,(H,20,21)
InChIKeyCGTQNWPJASJJGW-UHFFFAOYSA-N
MW300.33 g/mol
LogP2.68
Rot. Bonds4

About N-[[2-(4-fluorophenyl)-3-pyridinyl]methyl]oxolane-2-carboxamide

N-[[2-(4-fluorophenyl)-3-pyridinyl]methyl]oxolane-2-carboxamide (PubChem CID 53148241) has the molecular formula C17H17FN2O2 and a molecular weight of 300.33 g/mol. Its IUPAC name is N-[[2-(4-fluorophenyl)-3-pyridinyl]methyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[[2-(4-fluorophenyl)-3-pyridinyl]methyl]oxolane-2-carboxamide
PubChem CID53148241
Molecular FormulaC17H17FN2O2
Molecular Weight300.33 g/mol
Exact Mass300.13
IUPAC NameN-[[2-(4-fluorophenyl)-3-pyridinyl]methyl]oxolane-2-carboxamide
SMILESO=C(NCc1cccnc1-c1ccc(F)cc1)C1CCCO1
InChIInChI=1S/C17H17FN2O2/c18-14-7-5-12(6-8-14)16-13(3-1-9-19-16)11-20-17(21)15-4-2-10-22-15/h1,3,5-9,15H,2,4,10-11H2,(H,20,21)
InChIKeyCGTQNWPJASJJGW-UHFFFAOYSA-N
XLogP2.68
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.33
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[2-(4-fluorophenyl)-3-pyridinyl]methyl]oxolane-2-carboxamide 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-[[2-(4-fluorophenyl)-3-pyridinyl]methyl]oxolane-2-carboxamide?
The IUPAC name of N-[[2-(4-fluorophenyl)-3-pyridinyl]methyl]oxolane-2-carboxamide (CID 53148241) is N-[[2-(4-fluorophenyl)-3-pyridinyl]methyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[[2-(4-fluorophenyl)-3-pyridinyl]methyl]oxolane-2-carboxamide?
The canonical SMILES for N-[[2-(4-fluorophenyl)-3-pyridinyl]methyl]oxolane-2-carboxamide is O=C(NCc1cccnc1-c1ccc(F)cc1)C1CCCO1.
What is the InChIKey of N-[[2-(4-fluorophenyl)-3-pyridinyl]methyl]oxolane-2-carboxamide?
The InChIKey is CGTQNWPJASJJGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O2/c18-14-7-5-12(6-8-14)16-13(3-1-9-19-16)11-20-17(21)15-4-2-10-22-15/h1,3,5-9,15H,2,4,10-11H2,(H,20,21).
What are the key properties of N-[[2-(4-fluorophenyl)-3-pyridinyl]methyl]oxolane-2-carboxamide?
N-[[2-(4-fluorophenyl)-3-pyridinyl]methyl]oxolane-2-carboxamide has a molecular weight of 300.33 g/mol, XLogP of 2.68, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(4-fluorophenyl)-3-pyridinyl]methyl]oxolane-2-carboxamide is sourced from PubChem (CID 53148241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).