5-bromo-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidine

C11H16BrN3O — CID 65469032

IUPAC5-bromo-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidine
SMILESCN1CCCCC1COc1ncc(Br)cn1
InChIInChI=1S/C11H16BrN3O/c1-15-5-3-2-4-10(15)8-16-11-13-6-9(12)7-14-11/h6-7,10H,2-5,8H2,1H3
InChIKeyHTMNIFDKYNMIQB-UHFFFAOYSA-N
MW286.17 g/mol
LogP2.10
Rot. Bonds3

About 5-bromo-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidine

5-bromo-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidine (PubChem CID 65469032) has the molecular formula C11H16BrN3O and a molecular weight of 286.17 g/mol. Its IUPAC name is 5-bromo-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidine.

Molecular Properties

Compound Name5-bromo-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidine
PubChem CID65469032
Molecular FormulaC11H16BrN3O
Molecular Weight286.17 g/mol
Exact Mass285.05
IUPAC Name5-bromo-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidine
SMILESCN1CCCCC1COc1ncc(Br)cn1
InChIInChI=1S/C11H16BrN3O/c1-15-5-3-2-4-10(15)8-16-11-13-6-9(12)7-14-11/h6-7,10H,2-5,8H2,1H3
InChIKeyHTMNIFDKYNMIQB-UHFFFAOYSA-N
XLogP2.10
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.17
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-bromo-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidine 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

2-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-5-amine
CID 65472450
[4-methyl-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-5-yl]methanol
CID 83184394
2-[[(2R)-1-methylpiperidin-2-yl]methoxy]-1,3-thiazole
CID 164631730
3-methoxy-6-[(1-methylpiperidin-2-yl)methoxy]pyridazine
CID 117063213
2-[(1-methylpiperidin-2-yl)methoxy]pyrimidine-4-carboxylic acid
CID 107554961
4-[(1-methylpiperidin-2-yl)methoxy]pyridin-3-amine
CID 65472260
[6-[(1-methylpiperidin-2-yl)methoxy]pyrazin-2-yl]methanamine
CID 66465685
[4-[(1-methylpiperidin-2-yl)methoxy]-3-pyridinyl]methanamine
CID 81250968
6-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-carboxylic acid
CID 65471120
6-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-4-amine
CID 80877128
4-bromo-2-[(1-methylpiperidin-2-yl)methoxy]benzenecarbothioamide
CID 114903767
5-bromo-4-fluoro-2-[(1-methylpiperidin-2-yl)methoxy]aniline
CID 66110381

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidine?
The IUPAC name of 5-bromo-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidine (CID 65469032) is 5-bromo-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidine.
What is the SMILES notation for 5-bromo-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidine?
The canonical SMILES for 5-bromo-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidine is CN1CCCCC1COc1ncc(Br)cn1.
What is the InChIKey of 5-bromo-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidine?
The InChIKey is HTMNIFDKYNMIQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16BrN3O/c1-15-5-3-2-4-10(15)8-16-11-13-6-9(12)7-14-11/h6-7,10H,2-5,8H2,1H3.
What are the key properties of 5-bromo-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidine?
5-bromo-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidine has a molecular weight of 286.17 g/mol, XLogP of 2.10, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidine is sourced from PubChem (CID 65469032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).