4-[4-(2-methoxyphenyl)-6-phenylpyrimidin-2-yl]morpholine

C21H21N3O2 — CID 909883

IUPAC4-[4-(2-methoxyphenyl)-6-phenylpyrimidin-2-yl]morpholine
SMILESCOc1ccccc1-c1cc(-c2ccccc2)nc(N2CCOCC2)n1
InChIInChI=1S/C21H21N3O2/c1-25-20-10-6-5-9-17(20)19-15-18(16-7-3-2-4-8-16)22-21(23-19)24-11-13-26-14-12-24/h2-10,15H,11-14H2,1H3
InChIKeyDUGPZCWQGVGLIQ-UHFFFAOYSA-N
MW347.42 g/mol
LogP3.66
Rot. Bonds4

About 4-[4-(2-methoxyphenyl)-6-phenylpyrimidin-2-yl]morpholine

4-[4-(2-methoxyphenyl)-6-phenylpyrimidin-2-yl]morpholine (PubChem CID 909883) has the molecular formula C21H21N3O2 and a molecular weight of 347.42 g/mol. Its IUPAC name is 4-[4-(2-methoxyphenyl)-6-phenylpyrimidin-2-yl]morpholine.

Molecular Properties

Compound Name4-[4-(2-methoxyphenyl)-6-phenylpyrimidin-2-yl]morpholine
PubChem CID909883
Molecular FormulaC21H21N3O2
Molecular Weight347.42 g/mol
Exact Mass347.16
IUPAC Name4-[4-(2-methoxyphenyl)-6-phenylpyrimidin-2-yl]morpholine
SMILESCOc1ccccc1-c1cc(-c2ccccc2)nc(N2CCOCC2)n1
InChIInChI=1S/C21H21N3O2/c1-25-20-10-6-5-9-17(20)19-15-18(16-7-3-2-4-8-16)22-21(23-19)24-11-13-26-14-12-24/h2-10,15H,11-14H2,1H3
InChIKeyDUGPZCWQGVGLIQ-UHFFFAOYSA-N
XLogP3.66
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methoxyphenyl)-2-morpholin-4-yl-6-phenylpyrimidin-4-amine
CID 112935565
4-[4-(2,4-dimethoxyphenyl)-6-(4-methylphenyl)pyrimidin-2-yl]morpholine
CID 1338553
N-(3,4-dimethoxyphenyl)-2-morpholin-4-yl-6-phenylpyrimidin-4-amine
CID 112935575
2-morpholin-4-yl-6-phenylpyrimidine-4-carbonitrile
CID 698584
2-[6-(4-bromophenyl)-2-morpholin-4-ylpyrimidin-4-yl]phenol
CID 1110902
4-(3,4-dimethoxyphenyl)-6-phenyl-2-pyrrolidin-1-ylpyrimidine
CID 630454
6-(2-methoxyphenyl)-2-pyrrolidin-1-ylpyrimidine-4-carbonitrile
CID 39380251
4-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)-6-phenylpyrimidine
CID 1350768
4-[4-(2-methoxyphenyl)-2-pyridinyl]morpholine
CID 134375667
4-(3,4-dimethoxyphenyl)-2-(4-methylpiperidin-1-yl)-6-phenylpyrimidine
CID 2854001
4-(4-morpholin-4-yl-6-phenylpyrimidin-2-yl)piperazine-1-carbaldehyde
CID 112935367
N-benzyl-2-morpholin-4-yl-6-phenylpyrimidin-4-amine
CID 112935485

Frequently Asked Questions

What is the IUPAC name of 4-[4-(2-methoxyphenyl)-6-phenylpyrimidin-2-yl]morpholine?
The IUPAC name of 4-[4-(2-methoxyphenyl)-6-phenylpyrimidin-2-yl]morpholine (CID 909883) is 4-[4-(2-methoxyphenyl)-6-phenylpyrimidin-2-yl]morpholine.
What is the SMILES notation for 4-[4-(2-methoxyphenyl)-6-phenylpyrimidin-2-yl]morpholine?
The canonical SMILES for 4-[4-(2-methoxyphenyl)-6-phenylpyrimidin-2-yl]morpholine is COc1ccccc1-c1cc(-c2ccccc2)nc(N2CCOCC2)n1.
What is the InChIKey of 4-[4-(2-methoxyphenyl)-6-phenylpyrimidin-2-yl]morpholine?
The InChIKey is DUGPZCWQGVGLIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O2/c1-25-20-10-6-5-9-17(20)19-15-18(16-7-3-2-4-8-16)22-21(23-19)24-11-13-26-14-12-24/h2-10,15H,11-14H2,1H3.
What are the key properties of 4-[4-(2-methoxyphenyl)-6-phenylpyrimidin-2-yl]morpholine?
4-[4-(2-methoxyphenyl)-6-phenylpyrimidin-2-yl]morpholine has a molecular weight of 347.42 g/mol, XLogP of 3.66, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(2-methoxyphenyl)-6-phenylpyrimidin-2-yl]morpholine is sourced from PubChem (CID 909883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).