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

C8H9Cl2N3O — CID 11586699

IUPAC4-(2,6-dichloropyrimidin-4-yl)morpholine
SMILESClc1cc(N2CCOCC2)nc(Cl)n1
InChIInChI=1S/C8H9Cl2N3O/c9-6-5-7(12-8(10)11-6)13-1-3-14-4-2-13/h5H,1-4H2
InChIKeyQGGYMWHOBGSQCF-UHFFFAOYSA-N
MW234.09 g/mol
LogP1.62
Rot. Bonds1

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

4-(2,6-dichloropyrimidin-4-yl)morpholine (PubChem CID 11586699) has the molecular formula C8H9Cl2N3O and a molecular weight of 234.09 g/mol. Its IUPAC name is 4-(2,6-dichloropyrimidin-4-yl)morpholine.

Molecular Properties

Compound Name4-(2,6-dichloropyrimidin-4-yl)morpholine
PubChem CID11586699
Molecular FormulaC8H9Cl2N3O
Molecular Weight234.09 g/mol
Exact Mass233.01
IUPAC Name4-(2,6-dichloropyrimidin-4-yl)morpholine
SMILESClc1cc(N2CCOCC2)nc(Cl)n1
InChIInChI=1S/C8H9Cl2N3O/c9-6-5-7(12-8(10)11-6)13-1-3-14-4-2-13/h5H,1-4H2
InChIKeyQGGYMWHOBGSQCF-UHFFFAOYSA-N
XLogP1.62
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.09
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-Chloro-6-(morpholin-4-yl)pyrimidin-2-amine
CID 1484288
4-(4-Chloropyrimidin-2-yl)morpholine
CID 824643
4-(6-Chloropyrimidin-4-yl)morpholine
CID 796070
4-(4,6-Dichloropyrimidin-2-yl)morpholine
CID 2772068
4-[6-Chloro-2-(methylsulfanyl)-4-pyrimidinyl]morpholine
CID 1484294
4-chloro-N,N-dimethyl-6-morpholino-2-pyrimidinamine
CID 3424209
4-(2-Chloropyrimidin-4-yl)morpholine
CID 1714697
4,4'-(6-Chloropyrimidine-2,4-diyl)dimorpholine
CID 686334
4,6-Dichloro-2-(methoxymethyl)pyrimidine
CID 53438121
4,6-Dichloro-2-(ethoxymethyl)pyrimidine
CID 65669367
N4-methyl-6-morpholin-4-yl-pyrimidine-2,4-diamine
CID 80767642
4-(4,6-Dichloro-5-fluoropyrimidin-2-yl)morpholine
CID 59507617

Frequently Asked Questions

What is the IUPAC name of 4-(2,6-dichloropyrimidin-4-yl)morpholine?
The IUPAC name of 4-(2,6-dichloropyrimidin-4-yl)morpholine (CID 11586699) is 4-(2,6-dichloropyrimidin-4-yl)morpholine.
What is the SMILES notation for 4-(2,6-dichloropyrimidin-4-yl)morpholine?
The canonical SMILES for 4-(2,6-dichloropyrimidin-4-yl)morpholine is Clc1cc(N2CCOCC2)nc(Cl)n1.
What is the InChIKey of 4-(2,6-dichloropyrimidin-4-yl)morpholine?
The InChIKey is QGGYMWHOBGSQCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9Cl2N3O/c9-6-5-7(12-8(10)11-6)13-1-3-14-4-2-13/h5H,1-4H2.
What are the key properties of 4-(2,6-dichloropyrimidin-4-yl)morpholine?
4-(2,6-dichloropyrimidin-4-yl)morpholine has a molecular weight of 234.09 g/mol, XLogP of 1.62, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-dichloropyrimidin-4-yl)morpholine is sourced from PubChem (CID 11586699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).