(2-methoxy-3-pyridinyl)-[4-(5-morpholin-4-ylpyridazin-3-yl)piperazin-1-yl]methanone

C19H24N6O3 — CID 122355432

IUPAC(2-methoxy-3-pyridinyl)-[4-(5-morpholin-4-ylpyridazin-3-yl)piperazin-1-yl]methanone
SMILESCOc1ncccc1C(=O)N1CCN(c2cc(N3CCOCC3)cnn2)CC1
InChIInChI=1S/C19H24N6O3/c1-27-18-16(3-2-4-20-18)19(26)25-7-5-24(6-8-25)17-13-15(14-21-22-17)23-9-11-28-12-10-23/h2-4,13-14H,5-12H2,1H3
InChIKeyZZAKANZDRGLDOE-UHFFFAOYSA-N
MW384.44 g/mol
LogP0.68
Rot. Bonds4

About (2-methoxy-3-pyridinyl)-[4-(5-morpholin-4-ylpyridazin-3-yl)piperazin-1-yl]methanone

(2-methoxy-3-pyridinyl)-[4-(5-morpholin-4-ylpyridazin-3-yl)piperazin-1-yl]methanone (PubChem CID 122355432) has the molecular formula C19H24N6O3 and a molecular weight of 384.44 g/mol. Its IUPAC name is (2-methoxy-3-pyridinyl)-[4-(5-morpholin-4-ylpyridazin-3-yl)piperazin-1-yl]methanone.

Molecular Properties

Compound Name(2-methoxy-3-pyridinyl)-[4-(5-morpholin-4-ylpyridazin-3-yl)piperazin-1-yl]methanone
PubChem CID122355432
Molecular FormulaC19H24N6O3
Molecular Weight384.44 g/mol
Exact Mass384.19
IUPAC Name(2-methoxy-3-pyridinyl)-[4-(5-morpholin-4-ylpyridazin-3-yl)piperazin-1-yl]methanone
SMILESCOc1ncccc1C(=O)N1CCN(c2cc(N3CCOCC3)cnn2)CC1
InChIInChI=1S/C19H24N6O3/c1-27-18-16(3-2-4-20-18)19(26)25-7-5-24(6-8-25)17-13-15(14-21-22-17)23-9-11-28-12-10-23/h2-4,13-14H,5-12H2,1H3
InChIKeyZZAKANZDRGLDOE-UHFFFAOYSA-N
XLogP0.68
TPSA83.92 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 50.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of (2-methoxy-3-pyridinyl)-[4-(5-morpholin-4-ylpyridazin-3-yl)piperazin-1-yl]methanone?
The IUPAC name of (2-methoxy-3-pyridinyl)-[4-(5-morpholin-4-ylpyridazin-3-yl)piperazin-1-yl]methanone (CID 122355432) is (2-methoxy-3-pyridinyl)-[4-(5-morpholin-4-ylpyridazin-3-yl)piperazin-1-yl]methanone.
What is the SMILES notation for (2-methoxy-3-pyridinyl)-[4-(5-morpholin-4-ylpyridazin-3-yl)piperazin-1-yl]methanone?
The canonical SMILES for (2-methoxy-3-pyridinyl)-[4-(5-morpholin-4-ylpyridazin-3-yl)piperazin-1-yl]methanone is COc1ncccc1C(=O)N1CCN(c2cc(N3CCOCC3)cnn2)CC1.
What is the InChIKey of (2-methoxy-3-pyridinyl)-[4-(5-morpholin-4-ylpyridazin-3-yl)piperazin-1-yl]methanone?
The InChIKey is ZZAKANZDRGLDOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N6O3/c1-27-18-16(3-2-4-20-18)19(26)25-7-5-24(6-8-25)17-13-15(14-21-22-17)23-9-11-28-12-10-23/h2-4,13-14H,5-12H2,1H3.
What are the key properties of (2-methoxy-3-pyridinyl)-[4-(5-morpholin-4-ylpyridazin-3-yl)piperazin-1-yl]methanone?
(2-methoxy-3-pyridinyl)-[4-(5-morpholin-4-ylpyridazin-3-yl)piperazin-1-yl]methanone has a molecular weight of 384.44 g/mol, XLogP of 0.68, 4 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxy-3-pyridinyl)-[4-(5-morpholin-4-ylpyridazin-3-yl)piperazin-1-yl]methanone is sourced from PubChem (CID 122355432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).