2-morpholin-4-yl-N-(3-pyridazin-3-yl-1,7-naphthyridin-6-yl)acetamide

C18H18N6O2 — CID 138588047

IUPAC2-morpholin-4-yl-N-(3-pyridazin-3-yl-1,7-naphthyridin-6-yl)acetamide
SMILESO=C(CN1CCOCC1)Nc1cc2cc(-c3cccnn3)cnc2cn1
InChIInChI=1S/C18H18N6O2/c25-18(12-24-4-6-26-7-5-24)22-17-9-13-8-14(10-19-16(13)11-20-17)15-2-1-3-21-23-15/h1-3,8-11H,4-7,12H2,(H,20,22,25)
InChIKeyCLEZQSHKLYQYBG-UHFFFAOYSA-N
MW350.38 g/mol
LogP1.36
Rot. Bonds4

About 2-morpholin-4-yl-N-(3-pyridazin-3-yl-1,7-naphthyridin-6-yl)acetamide

2-morpholin-4-yl-N-(3-pyridazin-3-yl-1,7-naphthyridin-6-yl)acetamide (PubChem CID 138588047) has the molecular formula C18H18N6O2 and a molecular weight of 350.38 g/mol. Its IUPAC name is 2-morpholin-4-yl-N-(3-pyridazin-3-yl-1,7-naphthyridin-6-yl)acetamide.

Molecular Properties

Compound Name2-morpholin-4-yl-N-(3-pyridazin-3-yl-1,7-naphthyridin-6-yl)acetamide
PubChem CID138588047
Molecular FormulaC18H18N6O2
Molecular Weight350.38 g/mol
Exact Mass350.15
IUPAC Name2-morpholin-4-yl-N-(3-pyridazin-3-yl-1,7-naphthyridin-6-yl)acetamide
SMILESO=C(CN1CCOCC1)Nc1cc2cc(-c3cccnn3)cnc2cn1
InChIInChI=1S/C18H18N6O2/c25-18(12-24-4-6-26-7-5-24)22-17-9-13-8-14(10-19-16(13)11-20-17)15-2-1-3-21-23-15/h1-3,8-11H,4-7,12H2,(H,20,22,25)
InChIKeyCLEZQSHKLYQYBG-UHFFFAOYSA-N
XLogP1.36
TPSA93.13 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.38
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-N-(3-pyridazin-3-yl-1,7-naphthyridin-6-yl)acetamide?
The IUPAC name of 2-morpholin-4-yl-N-(3-pyridazin-3-yl-1,7-naphthyridin-6-yl)acetamide (CID 138588047) is 2-morpholin-4-yl-N-(3-pyridazin-3-yl-1,7-naphthyridin-6-yl)acetamide.
What is the SMILES notation for 2-morpholin-4-yl-N-(3-pyridazin-3-yl-1,7-naphthyridin-6-yl)acetamide?
The canonical SMILES for 2-morpholin-4-yl-N-(3-pyridazin-3-yl-1,7-naphthyridin-6-yl)acetamide is O=C(CN1CCOCC1)Nc1cc2cc(-c3cccnn3)cnc2cn1.
What is the InChIKey of 2-morpholin-4-yl-N-(3-pyridazin-3-yl-1,7-naphthyridin-6-yl)acetamide?
The InChIKey is CLEZQSHKLYQYBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N6O2/c25-18(12-24-4-6-26-7-5-24)22-17-9-13-8-14(10-19-16(13)11-20-17)15-2-1-3-21-23-15/h1-3,8-11H,4-7,12H2,(H,20,22,25).
What are the key properties of 2-morpholin-4-yl-N-(3-pyridazin-3-yl-1,7-naphthyridin-6-yl)acetamide?
2-morpholin-4-yl-N-(3-pyridazin-3-yl-1,7-naphthyridin-6-yl)acetamide has a molecular weight of 350.38 g/mol, XLogP of 1.36, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-N-(3-pyridazin-3-yl-1,7-naphthyridin-6-yl)acetamide is sourced from PubChem (CID 138588047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).