4-[5-(4-fluorophenyl)pyrimidin-2-yl]morpholine

C14H14FN3O — CID 4061604

IUPAC4-[5-(4-fluorophenyl)pyrimidin-2-yl]morpholine
SMILESFc1ccc(-c2cnc(N3CCOCC3)nc2)cc1
InChIInChI=1S/C14H14FN3O/c15-13-3-1-11(2-4-13)12-9-16-14(17-10-12)18-5-7-19-8-6-18/h1-4,9-10H,5-8H2
InChIKeyBYLGQHFNIGDRCJ-UHFFFAOYSA-N
MW259.28 g/mol
LogP2.12
Rot. Bonds2

About 4-[5-(4-fluorophenyl)pyrimidin-2-yl]morpholine

4-[5-(4-fluorophenyl)pyrimidin-2-yl]morpholine (PubChem CID 4061604) has the molecular formula C14H14FN3O and a molecular weight of 259.28 g/mol. Its IUPAC name is 4-[5-(4-fluorophenyl)pyrimidin-2-yl]morpholine.

Molecular Properties

Compound Name4-[5-(4-fluorophenyl)pyrimidin-2-yl]morpholine
PubChem CID4061604
Molecular FormulaC14H14FN3O
Molecular Weight259.28 g/mol
Exact Mass259.11
IUPAC Name4-[5-(4-fluorophenyl)pyrimidin-2-yl]morpholine
SMILESFc1ccc(-c2cnc(N3CCOCC3)nc2)cc1
InChIInChI=1S/C14H14FN3O/c15-13-3-1-11(2-4-13)12-9-16-14(17-10-12)18-5-7-19-8-6-18/h1-4,9-10H,5-8H2
InChIKeyBYLGQHFNIGDRCJ-UHFFFAOYSA-N
XLogP2.12
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.28
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-Phenylpyrimidin-2-amine
CID 12343511
N-benzyl-2-morpholinopyrimidin-4-amine
CID 46891015
(5-Fluoro-2-morpholin-4-ylpyrimidin-4-yl)benzylamine
CID 660212
2-[4-[(2-Fluorophenyl)methyl]piperazin-1-yl]pyrimidine
CID 764708
4-(4-Fluorophenyl)-2-morpholinonicotinonitrile
CID 1488775
4-(4-Fluorophenyl)-5-(2-morpholinoethyl)-2-pyrimidinamine
CID 3578049
2-[4-[4-(4-Fluorophenyl)butyl]piperazin-1-yl]pyrimidine
CID 57393083
5-Phenylpyrimidine
CID 817373
5-(4-Fluorophenyl)pyrimidin-4-amine
CID 321724
2-Chloro-5-phenylpyrimidine
CID 605320
2-morpholino-N-phenethylpyrimidin-4-amine
CID 46891060
2-[4-[(3-Fluorophenyl)methyl]-1-piperazinyl]pyrimidine
CID 763417

Frequently Asked Questions

What is the IUPAC name of 4-[5-(4-fluorophenyl)pyrimidin-2-yl]morpholine?
The IUPAC name of 4-[5-(4-fluorophenyl)pyrimidin-2-yl]morpholine (CID 4061604) is 4-[5-(4-fluorophenyl)pyrimidin-2-yl]morpholine.
What is the SMILES notation for 4-[5-(4-fluorophenyl)pyrimidin-2-yl]morpholine?
The canonical SMILES for 4-[5-(4-fluorophenyl)pyrimidin-2-yl]morpholine is Fc1ccc(-c2cnc(N3CCOCC3)nc2)cc1.
What is the InChIKey of 4-[5-(4-fluorophenyl)pyrimidin-2-yl]morpholine?
The InChIKey is BYLGQHFNIGDRCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN3O/c15-13-3-1-11(2-4-13)12-9-16-14(17-10-12)18-5-7-19-8-6-18/h1-4,9-10H,5-8H2.
What are the key properties of 4-[5-(4-fluorophenyl)pyrimidin-2-yl]morpholine?
4-[5-(4-fluorophenyl)pyrimidin-2-yl]morpholine has a molecular weight of 259.28 g/mol, XLogP of 2.12, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(4-fluorophenyl)pyrimidin-2-yl]morpholine is sourced from PubChem (CID 4061604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).