2-(4,6-dichloropyrimidin-2-yl)-4-ethylmorpholine

C10H13Cl2N3O — CID 79666573

IUPAC2-(4,6-dichloropyrimidin-2-yl)-4-ethylmorpholine
SMILESCCN1CCOC(c2nc(Cl)cc(Cl)n2)C1
InChIInChI=1S/C10H13Cl2N3O/c1-2-15-3-4-16-7(6-15)10-13-8(11)5-9(12)14-10/h5,7H,2-4,6H2,1H3
InChIKeySJKKEXUUOFEPSU-UHFFFAOYSA-N
MW262.14 g/mol
LogP2.18
Rot. Bonds2

About 2-(4,6-dichloropyrimidin-2-yl)-4-ethylmorpholine

2-(4,6-dichloropyrimidin-2-yl)-4-ethylmorpholine (PubChem CID 79666573) has the molecular formula C10H13Cl2N3O and a molecular weight of 262.14 g/mol. Its IUPAC name is 2-(4,6-dichloropyrimidin-2-yl)-4-ethylmorpholine.

Molecular Properties

Compound Name2-(4,6-dichloropyrimidin-2-yl)-4-ethylmorpholine
PubChem CID79666573
Molecular FormulaC10H13Cl2N3O
Molecular Weight262.14 g/mol
Exact Mass261.04
IUPAC Name2-(4,6-dichloropyrimidin-2-yl)-4-ethylmorpholine
SMILESCCN1CCOC(c2nc(Cl)cc(Cl)n2)C1
InChIInChI=1S/C10H13Cl2N3O/c1-2-15-3-4-16-7(6-15)10-13-8(11)5-9(12)14-10/h5,7H,2-4,6H2,1H3
InChIKeySJKKEXUUOFEPSU-UHFFFAOYSA-N
XLogP2.18
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.14
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(chloromethyl)-6-methylpyrimidin-2-yl]-4-ethylmorpholine
CID 79669673
2-(4,6-dichloro-5-propan-2-ylpyrimidin-2-yl)-4-ethylmorpholine
CID 79666831
2-(4-ethylmorpholin-2-yl)-6-methylpyrimidin-4-amine
CID 79669506
[2-(4-ethylmorpholin-2-yl)-6-methylpyrimidin-4-yl]hydrazine
CID 79669347
[2-(4-ethylmorpholin-2-yl)-4,6-dimethylpyrimidin-5-yl]methanamine
CID 79669278
6-cyclopropyl-2-(4-ethylmorpholin-2-yl)-N-methylpyrimidin-4-amine
CID 79669667
2-(4-tert-butyl-6-chloro-5-iodopyrimidin-2-yl)-4-ethylmorpholine
CID 79666071
6-ethyl-2-(4-ethylmorpholin-2-yl)-N-propylpyrimidin-4-amine
CID 79669666
2-[5-(1-chloroethyl)-4-methylpyrimidin-2-yl]-4-ethylmorpholine
CID 79669754
4-(4-ethylmorpholin-2-yl)-6-phenyl-1,3,5-triazin-2-amine
CID 79663052
[3-(4-ethylmorpholin-2-yl)-1H-1,2,4-triazol-5-yl]methanol
CID 79669524
2-(4-chloro-6-propan-2-ylpyrimidin-2-yl)-4-methylmorpholine
CID 79077687

Frequently Asked Questions

What is the IUPAC name of 2-(4,6-dichloropyrimidin-2-yl)-4-ethylmorpholine?
The IUPAC name of 2-(4,6-dichloropyrimidin-2-yl)-4-ethylmorpholine (CID 79666573) is 2-(4,6-dichloropyrimidin-2-yl)-4-ethylmorpholine.
What is the SMILES notation for 2-(4,6-dichloropyrimidin-2-yl)-4-ethylmorpholine?
The canonical SMILES for 2-(4,6-dichloropyrimidin-2-yl)-4-ethylmorpholine is CCN1CCOC(c2nc(Cl)cc(Cl)n2)C1.
What is the InChIKey of 2-(4,6-dichloropyrimidin-2-yl)-4-ethylmorpholine?
The InChIKey is SJKKEXUUOFEPSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13Cl2N3O/c1-2-15-3-4-16-7(6-15)10-13-8(11)5-9(12)14-10/h5,7H,2-4,6H2,1H3.
What are the key properties of 2-(4,6-dichloropyrimidin-2-yl)-4-ethylmorpholine?
2-(4,6-dichloropyrimidin-2-yl)-4-ethylmorpholine has a molecular weight of 262.14 g/mol, XLogP of 2.18, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,6-dichloropyrimidin-2-yl)-4-ethylmorpholine is sourced from PubChem (CID 79666573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).