4-(2-chloropyrimidin-4-yl)morpholine;ethane;tungsten

C10H16ClN3OW — CID 161195387

IUPAC4-(2-chloropyrimidin-4-yl)morpholine;ethane;tungsten
SMILESCC.Clc1nccc(N2CCOCC2)n1.[W]
InChIInChI=1S/C8H10ClN3O.C2H6.W/c9-8-10-2-1-7(11-8)12-3-5-13-6-4-12;1-2;/h1-2H,3-6H2;1-2H3;
InChIKeyUUGSHLLPIABPRB-UHFFFAOYSA-N
MW413.55 g/mol
LogP1.99
Rot. Bonds1

About 4-(2-chloropyrimidin-4-yl)morpholine;ethane;tungsten

4-(2-chloropyrimidin-4-yl)morpholine;ethane;tungsten (PubChem CID 161195387) has the molecular formula C10H16ClN3OW and a molecular weight of 413.55 g/mol. Its IUPAC name is 4-(2-chloropyrimidin-4-yl)morpholine;ethane;tungsten.

Molecular Properties

Compound Name4-(2-chloropyrimidin-4-yl)morpholine;ethane;tungsten
PubChem CID161195387
Molecular FormulaC10H16ClN3OW
Molecular Weight413.55 g/mol
Exact Mass413.05
IUPAC Name4-(2-chloropyrimidin-4-yl)morpholine;ethane;tungsten
SMILESCC.Clc1nccc(N2CCOCC2)n1.[W]
InChIInChI=1S/C8H10ClN3O.C2H6.W/c9-8-10-2-1-7(11-8)12-3-5-13-6-4-12;1-2;/h1-2H,3-6H2;1-2H3;
InChIKeyUUGSHLLPIABPRB-UHFFFAOYSA-N
XLogP1.99
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.55
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-chloropyrimidin-4-yl)-1,4-oxazepane
CID 62968346
4-[2-(2-chloro-5-methyl-1,3-thiazol-4-yl)pyrimidin-4-yl]morpholine
CID 58075056
methyl-(4-morpholin-4-ylpyrimidin-2-yl)phosphane
CID 134255137
2-chloro-4-(4-chloropiperidin-1-yl)pyrimidine
CID 142745770
1-(2-chloropyrimidin-4-yl)-4-methyl-1,4-diazepane
CID 62343451
2-chloro-4-(4,4-diethylpiperidin-1-yl)pyrimidine
CID 63161724
4-[2-methyl-6-[4-(2-methylpyrimidin-4-yl)piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 146074332
4-(2-piperidin-1-ylpyrimidin-4-yl)morpholine
CID 112884623
N-(3,4-dichlorophenyl)-4-morpholin-4-ylpyrimidin-2-amine
CID 112886522
1-[1-(2-chloropyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylmethanamine
CID 62344447
methyl 4-morpholin-4-ylpyrimidine-2-carboxylate
CID 150936080
4-[4-(4-phenylpiperazin-1-yl)pyrimidin-2-yl]morpholine
CID 112886572

Frequently Asked Questions

What is the IUPAC name of 4-(2-chloropyrimidin-4-yl)morpholine;ethane;tungsten?
The IUPAC name of 4-(2-chloropyrimidin-4-yl)morpholine;ethane;tungsten (CID 161195387) is 4-(2-chloropyrimidin-4-yl)morpholine;ethane;tungsten.
What is the SMILES notation for 4-(2-chloropyrimidin-4-yl)morpholine;ethane;tungsten?
The canonical SMILES for 4-(2-chloropyrimidin-4-yl)morpholine;ethane;tungsten is CC.Clc1nccc(N2CCOCC2)n1.[W].
What is the InChIKey of 4-(2-chloropyrimidin-4-yl)morpholine;ethane;tungsten?
The InChIKey is UUGSHLLPIABPRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClN3O.C2H6.W/c9-8-10-2-1-7(11-8)12-3-5-13-6-4-12;1-2;/h1-2H,3-6H2;1-2H3;.
What are the key properties of 4-(2-chloropyrimidin-4-yl)morpholine;ethane;tungsten?
4-(2-chloropyrimidin-4-yl)morpholine;ethane;tungsten has a molecular weight of 413.55 g/mol, XLogP of 1.99, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chloropyrimidin-4-yl)morpholine;ethane;tungsten is sourced from PubChem (CID 161195387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).