4-(6-naphthalen-2-yl-5-pyridin-4-ylpyridazin-3-yl)morpholine

C23H20N4O — CID 121317263

IUPAC4-(6-naphthalen-2-yl-5-pyridin-4-ylpyridazin-3-yl)morpholine
SMILESc1ccc2cc(-c3nnc(N4CCOCC4)cc3-c3ccncc3)ccc2c1
InChIInChI=1S/C23H20N4O/c1-2-4-19-15-20(6-5-17(19)3-1)23-21(18-7-9-24-10-8-18)16-22(25-26-23)27-11-13-28-14-12-27/h1-10,15-16H,11-14H2
InChIKeyOBTLBXGWTYQNNN-UHFFFAOYSA-N
MW368.44 g/mol
LogP4.20
Rot. Bonds3

About 4-(6-naphthalen-2-yl-5-pyridin-4-ylpyridazin-3-yl)morpholine

4-(6-naphthalen-2-yl-5-pyridin-4-ylpyridazin-3-yl)morpholine (PubChem CID 121317263) has the molecular formula C23H20N4O and a molecular weight of 368.44 g/mol. Its IUPAC name is 4-(6-naphthalen-2-yl-5-pyridin-4-ylpyridazin-3-yl)morpholine.

Molecular Properties

Compound Name4-(6-naphthalen-2-yl-5-pyridin-4-ylpyridazin-3-yl)morpholine
PubChem CID121317263
Molecular FormulaC23H20N4O
Molecular Weight368.44 g/mol
Exact Mass368.16
IUPAC Name4-(6-naphthalen-2-yl-5-pyridin-4-ylpyridazin-3-yl)morpholine
SMILESc1ccc2cc(-c3nnc(N4CCOCC4)cc3-c3ccncc3)ccc2c1
InChIInChI=1S/C23H20N4O/c1-2-4-19-15-20(6-5-17(19)3-1)23-21(18-7-9-24-10-8-18)16-22(25-26-23)27-11-13-28-14-12-27/h1-10,15-16H,11-14H2
InChIKeyOBTLBXGWTYQNNN-UHFFFAOYSA-N
XLogP4.20
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.44
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(6-naphthalen-2-yl-5-pyridin-4-ylpyridazin-3-yl)morpholine?
The IUPAC name of 4-(6-naphthalen-2-yl-5-pyridin-4-ylpyridazin-3-yl)morpholine (CID 121317263) is 4-(6-naphthalen-2-yl-5-pyridin-4-ylpyridazin-3-yl)morpholine.
What is the SMILES notation for 4-(6-naphthalen-2-yl-5-pyridin-4-ylpyridazin-3-yl)morpholine?
The canonical SMILES for 4-(6-naphthalen-2-yl-5-pyridin-4-ylpyridazin-3-yl)morpholine is c1ccc2cc(-c3nnc(N4CCOCC4)cc3-c3ccncc3)ccc2c1.
What is the InChIKey of 4-(6-naphthalen-2-yl-5-pyridin-4-ylpyridazin-3-yl)morpholine?
The InChIKey is OBTLBXGWTYQNNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O/c1-2-4-19-15-20(6-5-17(19)3-1)23-21(18-7-9-24-10-8-18)16-22(25-26-23)27-11-13-28-14-12-27/h1-10,15-16H,11-14H2.
What are the key properties of 4-(6-naphthalen-2-yl-5-pyridin-4-ylpyridazin-3-yl)morpholine?
4-(6-naphthalen-2-yl-5-pyridin-4-ylpyridazin-3-yl)morpholine has a molecular weight of 368.44 g/mol, XLogP of 4.20, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-naphthalen-2-yl-5-pyridin-4-ylpyridazin-3-yl)morpholine is sourced from PubChem (CID 121317263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).