3-(5-methylpyridazin-3-yl)-7-N-[5-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1,5-naphthyridine-2,7-diamine

C24H26N8O2 — CID 118497547

IUPAC3-(5-methylpyridazin-3-yl)-7-N-[5-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1,5-naphthyridine-2,7-diamine
SMILESCc1cnnc(-c2cc3ncc(Nc4cncc(OCCN5CCOCC5)c4)cc3nc2N)c1
InChIInChI=1S/C24H26N8O2/c1-16-8-21(31-28-12-16)20-11-22-23(30-24(20)25)10-18(14-27-22)29-17-9-19(15-26-13-17)34-7-4-32-2-5-33-6-3-32/h8-15,29H,2-7H2,1H3,(H2,25,30)
InChIKeyKVSAWZAAXAAUKR-UHFFFAOYSA-N
MW458.53 g/mol
LogP2.83
Rot. Bonds7

About 3-(5-methylpyridazin-3-yl)-7-N-[5-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1,5-naphthyridine-2,7-diamine

3-(5-methylpyridazin-3-yl)-7-N-[5-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1,5-naphthyridine-2,7-diamine (PubChem CID 118497547) has the molecular formula C24H26N8O2 and a molecular weight of 458.53 g/mol. Its IUPAC name is 3-(5-methylpyridazin-3-yl)-7-N-[5-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1,5-naphthyridine-2,7-diamine.

Molecular Properties

Compound Name3-(5-methylpyridazin-3-yl)-7-N-[5-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1,5-naphthyridine-2,7-diamine
PubChem CID118497547
Molecular FormulaC24H26N8O2
Molecular Weight458.53 g/mol
Exact Mass458.22
IUPAC Name3-(5-methylpyridazin-3-yl)-7-N-[5-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1,5-naphthyridine-2,7-diamine
SMILESCc1cnnc(-c2cc3ncc(Nc4cncc(OCCN5CCOCC5)c4)cc3nc2N)c1
InChIInChI=1S/C24H26N8O2/c1-16-8-21(31-28-12-16)20-11-22-23(30-24(20)25)10-18(14-27-22)29-17-9-19(15-26-13-17)34-7-4-32-2-5-33-6-3-32/h8-15,29H,2-7H2,1H3,(H2,25,30)
InChIKeyKVSAWZAAXAAUKR-UHFFFAOYSA-N
XLogP2.83
TPSA124.20 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500458.53
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Analyze 3-(5-methylpyridazin-3-yl)-7-N-[5-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1,5-naphthyridine-2,7-diamine 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 3-(5-methylpyridazin-3-yl)-7-N-[5-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1,5-naphthyridine-2,7-diamine?
The IUPAC name of 3-(5-methylpyridazin-3-yl)-7-N-[5-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1,5-naphthyridine-2,7-diamine (CID 118497547) is 3-(5-methylpyridazin-3-yl)-7-N-[5-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1,5-naphthyridine-2,7-diamine.
What is the SMILES notation for 3-(5-methylpyridazin-3-yl)-7-N-[5-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1,5-naphthyridine-2,7-diamine?
The canonical SMILES for 3-(5-methylpyridazin-3-yl)-7-N-[5-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1,5-naphthyridine-2,7-diamine is Cc1cnnc(-c2cc3ncc(Nc4cncc(OCCN5CCOCC5)c4)cc3nc2N)c1.
What is the InChIKey of 3-(5-methylpyridazin-3-yl)-7-N-[5-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1,5-naphthyridine-2,7-diamine?
The InChIKey is KVSAWZAAXAAUKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N8O2/c1-16-8-21(31-28-12-16)20-11-22-23(30-24(20)25)10-18(14-27-22)29-17-9-19(15-26-13-17)34-7-4-32-2-5-33-6-3-32/h8-15,29H,2-7H2,1H3,(H2,25,30).
What are the key properties of 3-(5-methylpyridazin-3-yl)-7-N-[5-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1,5-naphthyridine-2,7-diamine?
3-(5-methylpyridazin-3-yl)-7-N-[5-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1,5-naphthyridine-2,7-diamine has a molecular weight of 458.53 g/mol, XLogP of 2.83, 7 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methylpyridazin-3-yl)-7-N-[5-(2-morpholin-4-ylethoxy)-3-pyridinyl]-1,5-naphthyridine-2,7-diamine is sourced from PubChem (CID 118497547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).