7-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-N-(5-methyl-1-azabicyclo[2.2.1]hepta-2,4(7)-dien-2-yl)-1,5-naphthyridin-2-amine

C25H23N7 — CID 90289293

IUPAC7-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-N-(5-methyl-1-azabicyclo[2.2.1]hepta-2,4(7)-dien-2-yl)-1,5-naphthyridin-2-amine
SMILESCCn1cc(-c2cnc3ccc(Nc4cc5cn4CC5C)nc3c2)c(-c2ccncc2)n1
InChIInChI=1S/C25H23N7/c1-3-32-15-20(25(30-32)17-6-8-26-9-7-17)18-10-22-21(27-12-18)4-5-23(28-22)29-24-11-19-14-31(24)13-16(19)2/h4-12,14-16H,3,13H2,1-2H3,(H,28,29)
InChIKeyIBQOSJAVDRYGIO-UHFFFAOYSA-N
MW421.51 g/mol
LogP5.24
Rot. Bonds5

About 7-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-N-(5-methyl-1-azabicyclo[2.2.1]hepta-2,4(7)-dien-2-yl)-1,5-naphthyridin-2-amine

7-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-N-(5-methyl-1-azabicyclo[2.2.1]hepta-2,4(7)-dien-2-yl)-1,5-naphthyridin-2-amine (PubChem CID 90289293) has the molecular formula C25H23N7 and a molecular weight of 421.51 g/mol. Its IUPAC name is 7-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-N-(5-methyl-1-azabicyclo[2.2.1]hepta-2,4(7)-dien-2-yl)-1,5-naphthyridin-2-amine.

Molecular Properties

Compound Name7-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-N-(5-methyl-1-azabicyclo[2.2.1]hepta-2,4(7)-dien-2-yl)-1,5-naphthyridin-2-amine
PubChem CID90289293
Molecular FormulaC25H23N7
Molecular Weight421.51 g/mol
Exact Mass421.20
IUPAC Name7-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-N-(5-methyl-1-azabicyclo[2.2.1]hepta-2,4(7)-dien-2-yl)-1,5-naphthyridin-2-amine
SMILESCCn1cc(-c2cnc3ccc(Nc4cc5cn4CC5C)nc3c2)c(-c2ccncc2)n1
InChIInChI=1S/C25H23N7/c1-3-32-15-20(25(30-32)17-6-8-26-9-7-17)18-10-22-21(27-12-18)4-5-23(28-22)29-24-11-19-14-31(24)13-16(19)2/h4-12,14-16H,3,13H2,1-2H3,(H,28,29)
InChIKeyIBQOSJAVDRYGIO-UHFFFAOYSA-N
XLogP5.24
TPSA73.45 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.51
LogP ≤ 55.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 7-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-N-(5-methyl-1-azabicyclo[2.2.1]hepta-2,4(7)-dien-2-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 7-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-N-(5-methyl-1-azabicyclo[2.2.1]hepta-2,4(7)-dien-2-yl)-1,5-naphthyridin-2-amine?
The IUPAC name of 7-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-N-(5-methyl-1-azabicyclo[2.2.1]hepta-2,4(7)-dien-2-yl)-1,5-naphthyridin-2-amine (CID 90289293) is 7-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-N-(5-methyl-1-azabicyclo[2.2.1]hepta-2,4(7)-dien-2-yl)-1,5-naphthyridin-2-amine.
What is the SMILES notation for 7-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-N-(5-methyl-1-azabicyclo[2.2.1]hepta-2,4(7)-dien-2-yl)-1,5-naphthyridin-2-amine?
The canonical SMILES for 7-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-N-(5-methyl-1-azabicyclo[2.2.1]hepta-2,4(7)-dien-2-yl)-1,5-naphthyridin-2-amine is CCn1cc(-c2cnc3ccc(Nc4cc5cn4CC5C)nc3c2)c(-c2ccncc2)n1.
What is the InChIKey of 7-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-N-(5-methyl-1-azabicyclo[2.2.1]hepta-2,4(7)-dien-2-yl)-1,5-naphthyridin-2-amine?
The InChIKey is IBQOSJAVDRYGIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N7/c1-3-32-15-20(25(30-32)17-6-8-26-9-7-17)18-10-22-21(27-12-18)4-5-23(28-22)29-24-11-19-14-31(24)13-16(19)2/h4-12,14-16H,3,13H2,1-2H3,(H,28,29).
What are the key properties of 7-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-N-(5-methyl-1-azabicyclo[2.2.1]hepta-2,4(7)-dien-2-yl)-1,5-naphthyridin-2-amine?
7-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-N-(5-methyl-1-azabicyclo[2.2.1]hepta-2,4(7)-dien-2-yl)-1,5-naphthyridin-2-amine has a molecular weight of 421.51 g/mol, XLogP of 5.24, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1-ethyl-3-pyridin-4-ylpyrazol-4-yl)-N-(5-methyl-1-azabicyclo[2.2.1]hepta-2,4(7)-dien-2-yl)-1,5-naphthyridin-2-amine is sourced from PubChem (CID 90289293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).