N-[(4-fluorophenyl)methyl]-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine

C19H16FN5 — CID 122184265

IUPACN-[(4-fluorophenyl)methyl]-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine
SMILESCn1cc(-c2cnc3ccc(NCc4ccc(F)cc4)nc3c2)cn1
InChIInChI=1S/C19H16FN5/c1-25-12-15(11-23-25)14-8-18-17(21-10-14)6-7-19(24-18)22-9-13-2-4-16(20)5-3-13/h2-8,10-12H,9H2,1H3,(H,22,24)
InChIKeyGVTKZPZBSTYYGM-UHFFFAOYSA-N
MW333.37 g/mol
LogP3.78
Rot. Bonds4

About N-[(4-fluorophenyl)methyl]-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine

N-[(4-fluorophenyl)methyl]-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine (PubChem CID 122184265) has the molecular formula C19H16FN5 and a molecular weight of 333.37 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine
PubChem CID122184265
Molecular FormulaC19H16FN5
Molecular Weight333.37 g/mol
Exact Mass333.14
IUPAC NameN-[(4-fluorophenyl)methyl]-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine
SMILESCn1cc(-c2cnc3ccc(NCc4ccc(F)cc4)nc3c2)cn1
InChIInChI=1S/C19H16FN5/c1-25-12-15(11-23-25)14-8-18-17(21-10-14)6-7-19(24-18)22-9-13-2-4-16(20)5-3-13/h2-8,10-12H,9H2,1H3,(H,22,24)
InChIKeyGVTKZPZBSTYYGM-UHFFFAOYSA-N
XLogP3.78
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.37
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(4-fluorophenyl)methyl]-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine 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-[(4-fluorophenyl)methyl]-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine?
The IUPAC name of N-[(4-fluorophenyl)methyl]-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine (CID 122184265) is N-[(4-fluorophenyl)methyl]-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine is Cn1cc(-c2cnc3ccc(NCc4ccc(F)cc4)nc3c2)cn1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine?
The InChIKey is GVTKZPZBSTYYGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN5/c1-25-12-15(11-23-25)14-8-18-17(21-10-14)6-7-19(24-18)22-9-13-2-4-16(20)5-3-13/h2-8,10-12H,9H2,1H3,(H,22,24).
What are the key properties of N-[(4-fluorophenyl)methyl]-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine?
N-[(4-fluorophenyl)methyl]-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine has a molecular weight of 333.37 g/mol, XLogP of 3.78, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-7-(1-methylpyrazol-4-yl)-1,5-naphthyridin-2-amine is sourced from PubChem (CID 122184265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).