2-(6-pyridazin-3-yl-3-pyridin-2-yl-5-pyrimidin-2-yl-3,6-dihydro-2H-pyran-4-yl)pyrazine

C22H17N7O — CID 141075803

IUPAC2-(6-pyridazin-3-yl-3-pyridin-2-yl-5-pyrimidin-2-yl-3,6-dihydro-2H-pyran-4-yl)pyrazine
SMILESc1ccc(C2COC(c3cccnn3)C(c3ncccn3)=C2c2cnccn2)nc1
InChIInChI=1S/C22H17N7O/c1-2-7-24-16(5-1)15-14-30-21(17-6-3-10-28-29-17)20(22-26-8-4-9-27-22)19(15)18-13-23-11-12-25-18/h1-13,15,21H,14H2
InChIKeyQCQUQLRKDLVOOC-UHFFFAOYSA-N
MW395.43 g/mol
LogP2.92
Rot. Bonds4

About 2-(6-pyridazin-3-yl-3-pyridin-2-yl-5-pyrimidin-2-yl-3,6-dihydro-2H-pyran-4-yl)pyrazine

2-(6-pyridazin-3-yl-3-pyridin-2-yl-5-pyrimidin-2-yl-3,6-dihydro-2H-pyran-4-yl)pyrazine (PubChem CID 141075803) has the molecular formula C22H17N7O and a molecular weight of 395.43 g/mol. Its IUPAC name is 2-(6-pyridazin-3-yl-3-pyridin-2-yl-5-pyrimidin-2-yl-3,6-dihydro-2H-pyran-4-yl)pyrazine.

Molecular Properties

Compound Name2-(6-pyridazin-3-yl-3-pyridin-2-yl-5-pyrimidin-2-yl-3,6-dihydro-2H-pyran-4-yl)pyrazine
PubChem CID141075803
Molecular FormulaC22H17N7O
Molecular Weight395.43 g/mol
Exact Mass395.15
IUPAC Name2-(6-pyridazin-3-yl-3-pyridin-2-yl-5-pyrimidin-2-yl-3,6-dihydro-2H-pyran-4-yl)pyrazine
SMILESc1ccc(C2COC(c3cccnn3)C(c3ncccn3)=C2c2cnccn2)nc1
InChIInChI=1S/C22H17N7O/c1-2-7-24-16(5-1)15-14-30-21(17-6-3-10-28-29-17)20(22-26-8-4-9-27-22)19(15)18-13-23-11-12-25-18/h1-13,15,21H,14H2
InChIKeyQCQUQLRKDLVOOC-UHFFFAOYSA-N
XLogP2.92
TPSA99.46 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.43
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 2-(6-pyridazin-3-yl-3-pyridin-2-yl-5-pyrimidin-2-yl-3,6-dihydro-2H-pyran-4-yl)pyrazine with MolForge

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Launch Full Analysis

Related Compounds

2-methyl-N-[4-[5-[1-(pyridin-2-ylmethoxy)ethyl]-3-pyridinyl]-2-pyridinyl]pyrimidin-4-amine
CID 118249114
4-[(2S)-oxolan-2-yl]-5-pyrazin-2-yl-N-(pyridin-4-ylmethyl)pyrimidin-2-amine
CID 92415827
(2R,3aS,7aS)-5-(6-methylpyridazin-3-yl)-2-pyrimidin-4-yl-3,3a,4,6,7,7a-hexahydro-2H-furo[3,2-c]pyridine
CID 97411886
4-[(2-Methylpyrazol-3-yl)methyl]-2-(5-pyrimidin-5-yl-2-pyridinyl)morpholine
CID 118739858
4-[(1-Methylpyrazol-4-yl)methyl]-2-(6-pyrimidin-5-yl-2-pyridinyl)morpholine
CID 118747454
4-[(2-Methylpyrazol-3-yl)methyl]-2-(6-pyrimidin-5-yl-2-pyridinyl)morpholine
CID 118747456
4-(3-Pyridinyl)-2-[4-(2-pyridinylmethoxy)-1-piperidinyl]pyrimidine
CID 72903898
4-[(1-Methylpyrazol-4-yl)methyl]-2-(6-pyrimidin-5-yl-2-pyridinyl)morpholine;hydrobromide
CID 118747453
4-[(2-Methylpyrazol-3-yl)methyl]-2-(6-pyrimidin-5-yl-2-pyridinyl)morpholine;hydrobromide
CID 118747455
6-(methoxymethyl)-3-[4-(trifluoromethyl)pyridazin-3-yl]-N-[5-(trifluoromethyl)pyridin-2-yl]pyrido[2,3-b]pyrazin-8-amine
CID 59762759
(2R)-4-[6,7-dimethyl-4-[3-(trifluoromethyl)cyclobutyl]pteridin-2-yl]-2-(6-methylpyridazin-4-yl)morpholine
CID 157044389
6,7-dimethyl-2-[(2S,4S)-2-(2-methyl-4-pyridinyl)oxan-4-yl]-4-[6-(trifluoromethyl)-3-pyridinyl]pteridine
CID 157044401

Frequently Asked Questions

What is the IUPAC name of 2-(6-pyridazin-3-yl-3-pyridin-2-yl-5-pyrimidin-2-yl-3,6-dihydro-2H-pyran-4-yl)pyrazine?
The IUPAC name of 2-(6-pyridazin-3-yl-3-pyridin-2-yl-5-pyrimidin-2-yl-3,6-dihydro-2H-pyran-4-yl)pyrazine (CID 141075803) is 2-(6-pyridazin-3-yl-3-pyridin-2-yl-5-pyrimidin-2-yl-3,6-dihydro-2H-pyran-4-yl)pyrazine.
What is the SMILES notation for 2-(6-pyridazin-3-yl-3-pyridin-2-yl-5-pyrimidin-2-yl-3,6-dihydro-2H-pyran-4-yl)pyrazine?
The canonical SMILES for 2-(6-pyridazin-3-yl-3-pyridin-2-yl-5-pyrimidin-2-yl-3,6-dihydro-2H-pyran-4-yl)pyrazine is c1ccc(C2COC(c3cccnn3)C(c3ncccn3)=C2c2cnccn2)nc1.
What is the InChIKey of 2-(6-pyridazin-3-yl-3-pyridin-2-yl-5-pyrimidin-2-yl-3,6-dihydro-2H-pyran-4-yl)pyrazine?
The InChIKey is QCQUQLRKDLVOOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N7O/c1-2-7-24-16(5-1)15-14-30-21(17-6-3-10-28-29-17)20(22-26-8-4-9-27-22)19(15)18-13-23-11-12-25-18/h1-13,15,21H,14H2.
What are the key properties of 2-(6-pyridazin-3-yl-3-pyridin-2-yl-5-pyrimidin-2-yl-3,6-dihydro-2H-pyran-4-yl)pyrazine?
2-(6-pyridazin-3-yl-3-pyridin-2-yl-5-pyrimidin-2-yl-3,6-dihydro-2H-pyran-4-yl)pyrazine has a molecular weight of 395.43 g/mol, XLogP of 2.92, 4 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-pyridazin-3-yl-3-pyridin-2-yl-5-pyrimidin-2-yl-3,6-dihydro-2H-pyran-4-yl)pyrazine is sourced from PubChem (CID 141075803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).