4-[6-[5-(4-fluorophenyl)-3-pyridinyl]-2-methylpyrimidin-4-yl]morpholine

C20H19FN4O — CID 5087194

IUPAC4-[6-[5-(4-fluorophenyl)-3-pyridinyl]-2-methylpyrimidin-4-yl]morpholine
SMILESCc1nc(-c2cncc(-c3ccc(F)cc3)c2)cc(N2CCOCC2)n1
InChIInChI=1S/C20H19FN4O/c1-14-23-19(11-20(24-14)25-6-8-26-9-7-25)17-10-16(12-22-13-17)15-2-4-18(21)5-3-15/h2-5,10-13H,6-9H2,1H3
InChIKeyKJHAKBCWTFLMEQ-UHFFFAOYSA-N
MW350.40 g/mol
LogP3.49
Rot. Bonds3

About 4-[6-[5-(4-fluorophenyl)-3-pyridinyl]-2-methylpyrimidin-4-yl]morpholine

4-[6-[5-(4-fluorophenyl)-3-pyridinyl]-2-methylpyrimidin-4-yl]morpholine (PubChem CID 5087194) has the molecular formula C20H19FN4O and a molecular weight of 350.40 g/mol. Its IUPAC name is 4-[6-[5-(4-fluorophenyl)-3-pyridinyl]-2-methylpyrimidin-4-yl]morpholine.

Molecular Properties

Compound Name4-[6-[5-(4-fluorophenyl)-3-pyridinyl]-2-methylpyrimidin-4-yl]morpholine
PubChem CID5087194
Molecular FormulaC20H19FN4O
Molecular Weight350.40 g/mol
Exact Mass350.15
IUPAC Name4-[6-[5-(4-fluorophenyl)-3-pyridinyl]-2-methylpyrimidin-4-yl]morpholine
SMILESCc1nc(-c2cncc(-c3ccc(F)cc3)c2)cc(N2CCOCC2)n1
InChIInChI=1S/C20H19FN4O/c1-14-23-19(11-20(24-14)25-6-8-26-9-7-25)17-10-16(12-22-13-17)15-2-4-18(21)5-3-15/h2-5,10-13H,6-9H2,1H3
InChIKeyKJHAKBCWTFLMEQ-UHFFFAOYSA-N
XLogP3.49
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.40
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-[5-(4-fluorophenyl)-3-pyridinyl]-2-methyl-6-(4-methylpiperazin-1-yl)pyrimidine
CID 4625280
4-[6-[5-(4-fluorophenyl)-3-pyridinyl]-2-phenylpyrimidin-4-yl]morpholine
CID 5091017
ethyl 4-[6-[5-(4-fluorophenyl)-3-pyridinyl]-2-methylpyrimidin-4-yl]piperazine-1-carboxylate
CID 5058300
4-[5-(4-methoxyphenyl)-3-pyridinyl]-2-methyl-6-(4-methylpiperazin-1-yl)pyrimidine
CID 3653747
(4-fluorophenyl)-[4-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]methanone
CID 50748400
4-[2-phenyl-6-[5-[4-(trifluoromethoxy)phenyl]-3-pyridinyl]pyrimidin-4-yl]morpholine
CID 4086238
(5-fluoro-3-pyridinyl)-[4-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]methanone
CID 122340903
3-(4-fluorophenyl)-N-[2-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)oxyethyl]-1H-pyrazole-5-carboxamide
CID 90491814
4-[6-(azepan-1-yl)-2-methylpyrimidin-4-yl]morpholine
CID 112869889
4-[2-methyl-6-[2-methyl-4-(trifluoromethyl)pyrimidin-5-yl]pyrimidin-4-yl]morpholine
CID 143514854
4-fluoro-N-[2-[(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)amino]ethyl]benzamide
CID 56699188
5-(4,6-dimorpholin-4-yl-2-pyridinyl)pyridin-3-ol
CID 58507745

Frequently Asked Questions

What is the IUPAC name of 4-[6-[5-(4-fluorophenyl)-3-pyridinyl]-2-methylpyrimidin-4-yl]morpholine?
The IUPAC name of 4-[6-[5-(4-fluorophenyl)-3-pyridinyl]-2-methylpyrimidin-4-yl]morpholine (CID 5087194) is 4-[6-[5-(4-fluorophenyl)-3-pyridinyl]-2-methylpyrimidin-4-yl]morpholine.
What is the SMILES notation for 4-[6-[5-(4-fluorophenyl)-3-pyridinyl]-2-methylpyrimidin-4-yl]morpholine?
The canonical SMILES for 4-[6-[5-(4-fluorophenyl)-3-pyridinyl]-2-methylpyrimidin-4-yl]morpholine is Cc1nc(-c2cncc(-c3ccc(F)cc3)c2)cc(N2CCOCC2)n1.
What is the InChIKey of 4-[6-[5-(4-fluorophenyl)-3-pyridinyl]-2-methylpyrimidin-4-yl]morpholine?
The InChIKey is KJHAKBCWTFLMEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN4O/c1-14-23-19(11-20(24-14)25-6-8-26-9-7-25)17-10-16(12-22-13-17)15-2-4-18(21)5-3-15/h2-5,10-13H,6-9H2,1H3.
What are the key properties of 4-[6-[5-(4-fluorophenyl)-3-pyridinyl]-2-methylpyrimidin-4-yl]morpholine?
4-[6-[5-(4-fluorophenyl)-3-pyridinyl]-2-methylpyrimidin-4-yl]morpholine has a molecular weight of 350.40 g/mol, XLogP of 3.49, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-[5-(4-fluorophenyl)-3-pyridinyl]-2-methylpyrimidin-4-yl]morpholine is sourced from PubChem (CID 5087194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).