6-[(5-bromopyrimidin-4-yl)oxymethyl]-2,2-dimethylmorpholine

C11H16BrN3O2 — CID 114775968

IUPAC6-[(5-bromopyrimidin-4-yl)oxymethyl]-2,2-dimethylmorpholine
SMILESCC1(C)CNCC(COc2ncncc2Br)O1
InChIInChI=1S/C11H16BrN3O2/c1-11(2)6-13-3-8(17-11)5-16-10-9(12)4-14-7-15-10/h4,7-8,13H,3,5-6H2,1-2H3
InChIKeyNBSDRLJWXSHIFP-UHFFFAOYSA-N
MW302.17 g/mol
LogP1.38
Rot. Bonds3

About 6-[(5-bromopyrimidin-4-yl)oxymethyl]-2,2-dimethylmorpholine

6-[(5-bromopyrimidin-4-yl)oxymethyl]-2,2-dimethylmorpholine (PubChem CID 114775968) has the molecular formula C11H16BrN3O2 and a molecular weight of 302.17 g/mol. Its IUPAC name is 6-[(5-bromopyrimidin-4-yl)oxymethyl]-2,2-dimethylmorpholine.

Molecular Properties

Compound Name6-[(5-bromopyrimidin-4-yl)oxymethyl]-2,2-dimethylmorpholine
PubChem CID114775968
Molecular FormulaC11H16BrN3O2
Molecular Weight302.17 g/mol
Exact Mass301.04
IUPAC Name6-[(5-bromopyrimidin-4-yl)oxymethyl]-2,2-dimethylmorpholine
SMILESCC1(C)CNCC(COc2ncncc2Br)O1
InChIInChI=1S/C11H16BrN3O2/c1-11(2)6-13-3-8(17-11)5-16-10-9(12)4-14-7-15-10/h4,7-8,13H,3,5-6H2,1-2H3
InChIKeyNBSDRLJWXSHIFP-UHFFFAOYSA-N
XLogP1.38
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.17
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-[(5-bromopyrimidin-4-yl)oxymethyl]-2,2-dimethylmorpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[(5-bromo-4-methyl-2-pyridinyl)oxymethyl]-2,2-dimethylmorpholine
CID 114869831
6-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxymethyl]-2,2-dimethylmorpholine
CID 114775820
2,2-dimethyl-6-[(6-propoxypyrazin-2-yl)oxymethyl]morpholine
CID 114775746
6-[(6,6-dimethylmorpholin-2-yl)methoxy]pyridine-3-carbonitrile
CID 114775825
2,2-dimethyl-6-[(4-methylpyrimidin-2-yl)oxymethyl]morpholine
CID 114775795
6-[(6,6-dimethylmorpholin-2-yl)methoxy]-5-nitropyridine-3-carbonitrile
CID 103473350
6-[(5-chloro-3-nitro-2-pyridinyl)oxymethyl]-2,2-dimethylmorpholine
CID 114775810
2,2-dimethyl-6-[(1-methylimidazol-2-yl)oxymethyl]morpholine
CID 114775834
3-[(6,6-dimethylmorpholin-2-yl)methoxy]-1-ethylpyrazin-2-one
CID 114775957
4-[(6,6-dimethylmorpholin-2-yl)methoxy]benzonitrile
CID 114775943
6-[(4-methoxy-6-methylpyrimidin-2-yl)oxymethyl]-2,2-dimethylmorpholine
CID 114775691
5-bromo-4-(cyclopropylmethoxy)pyrimidine
CID 66320949

Frequently Asked Questions

What is the IUPAC name of 6-[(5-bromopyrimidin-4-yl)oxymethyl]-2,2-dimethylmorpholine?
The IUPAC name of 6-[(5-bromopyrimidin-4-yl)oxymethyl]-2,2-dimethylmorpholine (CID 114775968) is 6-[(5-bromopyrimidin-4-yl)oxymethyl]-2,2-dimethylmorpholine.
What is the SMILES notation for 6-[(5-bromopyrimidin-4-yl)oxymethyl]-2,2-dimethylmorpholine?
The canonical SMILES for 6-[(5-bromopyrimidin-4-yl)oxymethyl]-2,2-dimethylmorpholine is CC1(C)CNCC(COc2ncncc2Br)O1.
What is the InChIKey of 6-[(5-bromopyrimidin-4-yl)oxymethyl]-2,2-dimethylmorpholine?
The InChIKey is NBSDRLJWXSHIFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16BrN3O2/c1-11(2)6-13-3-8(17-11)5-16-10-9(12)4-14-7-15-10/h4,7-8,13H,3,5-6H2,1-2H3.
What are the key properties of 6-[(5-bromopyrimidin-4-yl)oxymethyl]-2,2-dimethylmorpholine?
6-[(5-bromopyrimidin-4-yl)oxymethyl]-2,2-dimethylmorpholine has a molecular weight of 302.17 g/mol, XLogP of 1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(5-bromopyrimidin-4-yl)oxymethyl]-2,2-dimethylmorpholine is sourced from PubChem (CID 114775968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).