4-(5-fluoro-4-methoxypyrimidin-2-yl)-2-(2-methoxyethyl)morpholine

C12H18FN3O3 — CID 131900324

IUPAC4-(5-fluoro-4-methoxypyrimidin-2-yl)-2-(2-methoxyethyl)morpholine
SMILESCOCCC1CN(c2ncc(F)c(OC)n2)CCO1
InChIInChI=1S/C12H18FN3O3/c1-17-5-3-9-8-16(4-6-19-9)12-14-7-10(13)11(15-12)18-2/h7,9H,3-6,8H2,1-2H3
InChIKeyRHPBBYYCKRRVMD-UHFFFAOYSA-N
MW271.29 g/mol
LogP0.87
Rot. Bonds5

About 4-(5-fluoro-4-methoxypyrimidin-2-yl)-2-(2-methoxyethyl)morpholine

4-(5-fluoro-4-methoxypyrimidin-2-yl)-2-(2-methoxyethyl)morpholine (PubChem CID 131900324) has the molecular formula C12H18FN3O3 and a molecular weight of 271.29 g/mol. Its IUPAC name is 4-(5-fluoro-4-methoxypyrimidin-2-yl)-2-(2-methoxyethyl)morpholine.

Molecular Properties

Compound Name4-(5-fluoro-4-methoxypyrimidin-2-yl)-2-(2-methoxyethyl)morpholine
PubChem CID131900324
Molecular FormulaC12H18FN3O3
Molecular Weight271.29 g/mol
Exact Mass271.13
IUPAC Name4-(5-fluoro-4-methoxypyrimidin-2-yl)-2-(2-methoxyethyl)morpholine
SMILESCOCCC1CN(c2ncc(F)c(OC)n2)CCO1
InChIInChI=1S/C12H18FN3O3/c1-17-5-3-9-8-16(4-6-19-9)12-14-7-10(13)11(15-12)18-2/h7,9H,3-6,8H2,1-2H3
InChIKeyRHPBBYYCKRRVMD-UHFFFAOYSA-N
XLogP0.87
TPSA56.71 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.29
LogP ≤ 50.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-[1-(cyclopropylmethyl)-4-(5-fluoro-4-methoxypyrimidin-2-yl)piperazin-2-yl]ethanol
CID 131931388
(2S)-4-(6-ethyl-2-morpholin-4-ylpyrimidin-4-yl)-2-(2-methoxyethyl)morpholine
CID 95123943
[4-(5-fluoropyrimidin-2-yl)morpholin-2-yl]methanol
CID 115750247
(2R)-4-[4-(4-chloro-2-fluorophenyl)-7-methylpteridin-2-yl]-2-(3-methoxypropyl)morpholine
CID 170231345
(2S)-4-(6-tert-butyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2-(2-methoxyethyl)morpholine
CID 95713086
4-(6-tert-butyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2-(2-methoxyethyl)morpholine
CID 56890005
[(3R,4R)-1-(5-fluoro-4-morpholin-4-ylpyrimidin-2-yl)-4-[[2-methoxyethyl(methyl)amino]methyl]pyrrolidin-3-yl]methanol
CID 70768224
4-[2-(2-methoxyethyl)morpholin-4-yl]-5,6,7,8-tetrahydroquinazolin-2-amine
CID 155955250
1-[(3R,4S)-1-(5-fluoro-4-methoxypyrimidin-2-yl)-4-hydroxypyrrolidin-3-yl]-N,N-dimethylmethanesulfonamide
CID 134711555
4-[(2-fluoro-4-methoxyphenyl)methyl]-2-(2-methoxyethyl)morpholine
CID 74247681
N-[(2,4-dichlorophenyl)methyl]-1-(5-fluoro-4-methoxypyrimidin-2-yl)pyrrolidin-3-amine
CID 66855357
5-fluoro-4-methoxy-2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]pyrimidine
CID 134704475

Frequently Asked Questions

What is the IUPAC name of 4-(5-fluoro-4-methoxypyrimidin-2-yl)-2-(2-methoxyethyl)morpholine?
The IUPAC name of 4-(5-fluoro-4-methoxypyrimidin-2-yl)-2-(2-methoxyethyl)morpholine (CID 131900324) is 4-(5-fluoro-4-methoxypyrimidin-2-yl)-2-(2-methoxyethyl)morpholine.
What is the SMILES notation for 4-(5-fluoro-4-methoxypyrimidin-2-yl)-2-(2-methoxyethyl)morpholine?
The canonical SMILES for 4-(5-fluoro-4-methoxypyrimidin-2-yl)-2-(2-methoxyethyl)morpholine is COCCC1CN(c2ncc(F)c(OC)n2)CCO1.
What is the InChIKey of 4-(5-fluoro-4-methoxypyrimidin-2-yl)-2-(2-methoxyethyl)morpholine?
The InChIKey is RHPBBYYCKRRVMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18FN3O3/c1-17-5-3-9-8-16(4-6-19-9)12-14-7-10(13)11(15-12)18-2/h7,9H,3-6,8H2,1-2H3.
What are the key properties of 4-(5-fluoro-4-methoxypyrimidin-2-yl)-2-(2-methoxyethyl)morpholine?
4-(5-fluoro-4-methoxypyrimidin-2-yl)-2-(2-methoxyethyl)morpholine has a molecular weight of 271.29 g/mol, XLogP of 0.87, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-fluoro-4-methoxypyrimidin-2-yl)-2-(2-methoxyethyl)morpholine is sourced from PubChem (CID 131900324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).