4-[[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]amino]-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide

C26H24F2N6O — CID 53372594

IUPAC4-[[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]amino]-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide
SMILESCN1CCC(NC(=O)c2cnccc2Nc2cc(-c3cc(F)ccc3F)nc3ncccc23)CC1
InChIInChI=1S/C26H24F2N6O/c1-34-11-7-17(8-12-34)31-26(35)20-15-29-10-6-22(20)32-23-14-24(19-13-16(27)4-5-21(19)28)33-25-18(23)3-2-9-30-25/h2-6,9-10,13-15,17H,7-8,11-12H2,1H3,(H,31,35)(H,29,30,32,33)
InChIKeyGLTMUZPVSOOZLC-UHFFFAOYSA-N
MW474.52 g/mol
LogP4.54
Rot. Bonds5

About 4-[[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]amino]-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide

4-[[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]amino]-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide (PubChem CID 53372594) has the molecular formula C26H24F2N6O and a molecular weight of 474.52 g/mol. Its IUPAC name is 4-[[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]amino]-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-[[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]amino]-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide
PubChem CID53372594
Molecular FormulaC26H24F2N6O
Molecular Weight474.52 g/mol
Exact Mass474.20
IUPAC Name4-[[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]amino]-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide
SMILESCN1CCC(NC(=O)c2cnccc2Nc2cc(-c3cc(F)ccc3F)nc3ncccc23)CC1
InChIInChI=1S/C26H24F2N6O/c1-34-11-7-17(8-12-34)31-26(35)20-15-29-10-6-22(20)32-23-14-24(19-13-16(27)4-5-21(19)28)33-25-18(23)3-2-9-30-25/h2-6,9-10,13-15,17H,7-8,11-12H2,1H3,(H,31,35)(H,29,30,32,33)
InChIKeyGLTMUZPVSOOZLC-UHFFFAOYSA-N
XLogP4.54
TPSA83.04 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500474.52
LogP ≤ 54.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-[[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]amino]-N-(1-methylpiperidin-4-yl)pyridine-3-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 4-[[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]amino]-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide?
The IUPAC name of 4-[[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]amino]-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide (CID 53372594) is 4-[[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]amino]-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide.
What is the SMILES notation for 4-[[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]amino]-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide?
The canonical SMILES for 4-[[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]amino]-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide is CN1CCC(NC(=O)c2cnccc2Nc2cc(-c3cc(F)ccc3F)nc3ncccc23)CC1.
What is the InChIKey of 4-[[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]amino]-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide?
The InChIKey is GLTMUZPVSOOZLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24F2N6O/c1-34-11-7-17(8-12-34)31-26(35)20-15-29-10-6-22(20)32-23-14-24(19-13-16(27)4-5-21(19)28)33-25-18(23)3-2-9-30-25/h2-6,9-10,13-15,17H,7-8,11-12H2,1H3,(H,31,35)(H,29,30,32,33).
What are the key properties of 4-[[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]amino]-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide?
4-[[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]amino]-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide has a molecular weight of 474.52 g/mol, XLogP of 4.54, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]amino]-N-(1-methylpiperidin-4-yl)pyridine-3-carboxamide is sourced from PubChem (CID 53372594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).