2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide

C19H23N5O3 — CID 122278617

IUPAC2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide
SMILESO=C(Cn1nc(C2CC2)ccc1=O)NCc1ccnc(N2CCOCC2)c1
InChIInChI=1S/C19H23N5O3/c25-18(13-24-19(26)4-3-16(22-24)15-1-2-15)21-12-14-5-6-20-17(11-14)23-7-9-27-10-8-23/h3-6,11,15H,1-2,7-10,12-13H2,(H,21,25)
InChIKeyGYGWOMYPLRNKOW-UHFFFAOYSA-N
MW369.43 g/mol
LogP0.67
Rot. Bonds6

About 2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide

2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide (PubChem CID 122278617) has the molecular formula C19H23N5O3 and a molecular weight of 369.43 g/mol. Its IUPAC name is 2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide.

Molecular Properties

Compound Name2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide
PubChem CID122278617
Molecular FormulaC19H23N5O3
Molecular Weight369.43 g/mol
Exact Mass369.18
IUPAC Name2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide
SMILESO=C(Cn1nc(C2CC2)ccc1=O)NCc1ccnc(N2CCOCC2)c1
InChIInChI=1S/C19H23N5O3/c25-18(13-24-19(26)4-3-16(22-24)15-1-2-15)21-12-14-5-6-20-17(11-14)23-7-9-27-10-8-23/h3-6,11,15H,1-2,7-10,12-13H2,(H,21,25)
InChIKeyGYGWOMYPLRNKOW-UHFFFAOYSA-N
XLogP0.67
TPSA89.35 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.43
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide?
The IUPAC name of 2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide (CID 122278617) is 2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide.
What is the SMILES notation for 2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide?
The canonical SMILES for 2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide is O=C(Cn1nc(C2CC2)ccc1=O)NCc1ccnc(N2CCOCC2)c1.
What is the InChIKey of 2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide?
The InChIKey is GYGWOMYPLRNKOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O3/c25-18(13-24-19(26)4-3-16(22-24)15-1-2-15)21-12-14-5-6-20-17(11-14)23-7-9-27-10-8-23/h3-6,11,15H,1-2,7-10,12-13H2,(H,21,25).
What are the key properties of 2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide?
2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide has a molecular weight of 369.43 g/mol, XLogP of 0.67, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide is sourced from PubChem (CID 122278617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).