4-[6-(4-chlorophenoxy)pyrimidin-4-yl]morpholine

C14H14ClN3O2 — CID 24715702

IUPAC4-[6-(4-chlorophenoxy)pyrimidin-4-yl]morpholine
SMILESClc1ccc(Oc2cc(N3CCOCC3)ncn2)cc1
InChIInChI=1S/C14H14ClN3O2/c15-11-1-3-12(4-2-11)20-14-9-13(16-10-17-14)18-5-7-19-8-6-18/h1-4,9-10H,5-8H2
InChIKeySUFCPBKDBKJNCC-UHFFFAOYSA-N
MW291.74 g/mol
LogP2.76
Rot. Bonds3

About 4-[6-(4-chlorophenoxy)pyrimidin-4-yl]morpholine

4-[6-(4-chlorophenoxy)pyrimidin-4-yl]morpholine (PubChem CID 24715702) has the molecular formula C14H14ClN3O2 and a molecular weight of 291.74 g/mol. Its IUPAC name is 4-[6-(4-chlorophenoxy)pyrimidin-4-yl]morpholine.

Molecular Properties

Compound Name4-[6-(4-chlorophenoxy)pyrimidin-4-yl]morpholine
PubChem CID24715702
Molecular FormulaC14H14ClN3O2
Molecular Weight291.74 g/mol
Exact Mass291.08
IUPAC Name4-[6-(4-chlorophenoxy)pyrimidin-4-yl]morpholine
SMILESClc1ccc(Oc2cc(N3CCOCC3)ncn2)cc1
InChIInChI=1S/C14H14ClN3O2/c15-11-1-3-12(4-2-11)20-14-9-13(16-10-17-14)18-5-7-19-8-6-18/h1-4,9-10H,5-8H2
InChIKeySUFCPBKDBKJNCC-UHFFFAOYSA-N
XLogP2.76
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.74
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-chlorophenoxy)-N-(pyrimidin-2-yl)acetamide
CID 686157
Pyrimidine, 4-chloro-6-(4-chlorophenoxy)-
CID 3079025
BW 48-122
CID 72999
N,N-diethyl-6-phenoxypyrimidin-4-amine
CID 2055860
2-(4-Chlorophenoxy)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone
CID 2103434
2-(1-(6-(3-Chlorophenoxy)pyrimidin-4-yl)piperidin-4-yloxy)-5-fluoropyrimidin-4-amine
CID 25026493
2-(1-(6-(4-Chlorophenoxy)pyrimidin-4-yl)piperidin-4-yloxy)-5-fluoropyrimidin-4-amine
CID 25026689
[4-(4-Chlorophenoxy)piperidin-1-yl]-[1-(6-morpholin-4-ylpyrimidin-4-yl)piperidin-4-yl]methanone
CID 155519086
8-Chloro-4-(4-morpholinyl)pyrimido[4,5-b][1,4]benzoxazepine
CID 658248
4-Chloro-6-(4-chlorophenoxy)pyrimidin-2-amine
CID 389506
4-Chloro-6-phenoxypyrimidine
CID 11593677
[2-(4-Chloro-phenoxy)-ethyl]-(4,6-dimethyl-pyrimidin-2-yl)-cyanamide
CID 766339

Frequently Asked Questions

What is the IUPAC name of 4-[6-(4-chlorophenoxy)pyrimidin-4-yl]morpholine?
The IUPAC name of 4-[6-(4-chlorophenoxy)pyrimidin-4-yl]morpholine (CID 24715702) is 4-[6-(4-chlorophenoxy)pyrimidin-4-yl]morpholine.
What is the SMILES notation for 4-[6-(4-chlorophenoxy)pyrimidin-4-yl]morpholine?
The canonical SMILES for 4-[6-(4-chlorophenoxy)pyrimidin-4-yl]morpholine is Clc1ccc(Oc2cc(N3CCOCC3)ncn2)cc1.
What is the InChIKey of 4-[6-(4-chlorophenoxy)pyrimidin-4-yl]morpholine?
The InChIKey is SUFCPBKDBKJNCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O2/c15-11-1-3-12(4-2-11)20-14-9-13(16-10-17-14)18-5-7-19-8-6-18/h1-4,9-10H,5-8H2.
What are the key properties of 4-[6-(4-chlorophenoxy)pyrimidin-4-yl]morpholine?
4-[6-(4-chlorophenoxy)pyrimidin-4-yl]morpholine has a molecular weight of 291.74 g/mol, XLogP of 2.76, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-(4-chlorophenoxy)pyrimidin-4-yl]morpholine is sourced from PubChem (CID 24715702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).