morpholin-4-yl-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4-pyridinyl]methanone

C19H22N6O3 — CID 109082844

IUPACmorpholin-4-yl-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4-pyridinyl]methanone
SMILESO=C(c1ccnc(C(=O)N2CCN(c3ncccn3)CC2)c1)N1CCOCC1
InChIInChI=1S/C19H22N6O3/c26-17(24-10-12-28-13-11-24)15-2-5-20-16(14-15)18(27)23-6-8-25(9-7-23)19-21-3-1-4-22-19/h1-5,14H,6-13H2
InChIKeyJGUOZDBJIXREQM-UHFFFAOYSA-N
MW382.42 g/mol
LogP0.31
Rot. Bonds3

About morpholin-4-yl-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4-pyridinyl]methanone

morpholin-4-yl-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4-pyridinyl]methanone (PubChem CID 109082844) has the molecular formula C19H22N6O3 and a molecular weight of 382.42 g/mol. Its IUPAC name is morpholin-4-yl-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4-pyridinyl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4-pyridinyl]methanone
PubChem CID109082844
Molecular FormulaC19H22N6O3
Molecular Weight382.42 g/mol
Exact Mass382.18
IUPAC Namemorpholin-4-yl-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4-pyridinyl]methanone
SMILESO=C(c1ccnc(C(=O)N2CCN(c3ncccn3)CC2)c1)N1CCOCC1
InChIInChI=1S/C19H22N6O3/c26-17(24-10-12-28-13-11-24)15-2-5-20-16(14-15)18(27)23-6-8-25(9-7-23)19-21-3-1-4-22-19/h1-5,14H,6-13H2
InChIKeyJGUOZDBJIXREQM-UHFFFAOYSA-N
XLogP0.31
TPSA91.76 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.42
LogP ≤ 50.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze morpholin-4-yl-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4-pyridinyl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

piperidin-1-yl-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4-pyridinyl]methanone
CID 109081080
[6-(morpholine-4-carbonyl)-2-pyridinyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 109096023
[4-(furan-2-carbonyl)piperazin-1-yl]-[2-(morpholine-4-carbonyl)-4-pyridinyl]methanone
CID 109083000
[2-(4-phenylpiperazine-1-carbonyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109080358
3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 27647571
[2-[4-(morpholine-4-carbonyl)-2-pyridinyl]-4-pyridinyl]-morpholin-4-ylmethanone
CID 171623322
[3-(4-pyrimidin-2-ylpiperazine-1-carbonyl)phenyl]-pyrrolidin-1-ylmethanone
CID 109051678
4-(4-morpholin-4-ylsulfonylpiperazine-1-carbonyl)pyridine-2-carboxylic acid
CID 119181220
azepan-1-yl-[3-(4-pyrimidin-2-ylpiperazine-1-carbonyl)phenyl]methanone
CID 109055810
[6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-3-pyridinyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 4155185
N-(2-methylpropyl)-2-(morpholine-4-carbonyl)pyridine-4-carboxamide
CID 109079570
(3-methylphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 4993620

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4-pyridinyl]methanone?
The IUPAC name of morpholin-4-yl-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4-pyridinyl]methanone (CID 109082844) is morpholin-4-yl-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4-pyridinyl]methanone.
What is the SMILES notation for morpholin-4-yl-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4-pyridinyl]methanone?
The canonical SMILES for morpholin-4-yl-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4-pyridinyl]methanone is O=C(c1ccnc(C(=O)N2CCN(c3ncccn3)CC2)c1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4-pyridinyl]methanone?
The InChIKey is JGUOZDBJIXREQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O3/c26-17(24-10-12-28-13-11-24)15-2-5-20-16(14-15)18(27)23-6-8-25(9-7-23)19-21-3-1-4-22-19/h1-5,14H,6-13H2.
What are the key properties of morpholin-4-yl-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4-pyridinyl]methanone?
morpholin-4-yl-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4-pyridinyl]methanone has a molecular weight of 382.42 g/mol, XLogP of 0.31, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4-pyridinyl]methanone is sourced from PubChem (CID 109082844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).