5-fluoro-N-[(2-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide

C19H21FN2O3 — CID 84600208

IUPAC5-fluoro-N-[(2-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
SMILESCOc1ccccc1CN(CC1CCCO1)C(=O)c1ccc(F)cn1
InChIInChI=1S/C19H21FN2O3/c1-24-18-7-3-2-5-14(18)12-22(13-16-6-4-10-25-16)19(23)17-9-8-15(20)11-21-17/h2-3,5,7-9,11,16H,4,6,10,12-13H2,1H3
InChIKeyYFCLUYGLVBHOLC-UHFFFAOYSA-N
MW344.39 g/mol
LogP3.05
Rot. Bonds6

About 5-fluoro-N-[(2-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide

5-fluoro-N-[(2-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide (PubChem CID 84600208) has the molecular formula C19H21FN2O3 and a molecular weight of 344.39 g/mol. Its IUPAC name is 5-fluoro-N-[(2-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-fluoro-N-[(2-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
PubChem CID84600208
Molecular FormulaC19H21FN2O3
Molecular Weight344.39 g/mol
Exact Mass344.15
IUPAC Name5-fluoro-N-[(2-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
SMILESCOc1ccccc1CN(CC1CCCO1)C(=O)c1ccc(F)cn1
InChIInChI=1S/C19H21FN2O3/c1-24-18-7-3-2-5-14(18)12-22(13-16-6-4-10-25-16)19(23)17-9-8-15(20)11-21-17/h2-3,5,7-9,11,16H,4,6,10,12-13H2,1H3
InChIKeyYFCLUYGLVBHOLC-UHFFFAOYSA-N
XLogP3.05
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.39
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-fluoro-N-[(2-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)pyridine-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 5-fluoro-N-[(2-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide?
The IUPAC name of 5-fluoro-N-[(2-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide (CID 84600208) is 5-fluoro-N-[(2-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-fluoro-N-[(2-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide?
The canonical SMILES for 5-fluoro-N-[(2-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide is COc1ccccc1CN(CC1CCCO1)C(=O)c1ccc(F)cn1.
What is the InChIKey of 5-fluoro-N-[(2-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide?
The InChIKey is YFCLUYGLVBHOLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O3/c1-24-18-7-3-2-5-14(18)12-22(13-16-6-4-10-25-16)19(23)17-9-8-15(20)11-21-17/h2-3,5,7-9,11,16H,4,6,10,12-13H2,1H3.
What are the key properties of 5-fluoro-N-[(2-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide?
5-fluoro-N-[(2-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide has a molecular weight of 344.39 g/mol, XLogP of 3.05, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-[(2-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide is sourced from PubChem (CID 84600208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).