[4-methyl-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-5-yl]methanol

C13H21N3O2 — CID 83184394

IUPAC[4-methyl-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-5-yl]methanol
SMILESCc1nc(OCC2CCCCN2C)ncc1CO
InChIInChI=1S/C13H21N3O2/c1-10-11(8-17)7-14-13(15-10)18-9-12-5-3-4-6-16(12)2/h7,12,17H,3-6,8-9H2,1-2H3
InChIKeyJMMUGSCUDINJDG-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.14
Rot. Bonds4

About [4-methyl-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-5-yl]methanol

[4-methyl-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-5-yl]methanol (PubChem CID 83184394) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is [4-methyl-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-5-yl]methanol.

Molecular Properties

Compound Name[4-methyl-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-5-yl]methanol
PubChem CID83184394
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC Name[4-methyl-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-5-yl]methanol
SMILESCc1nc(OCC2CCCCN2C)ncc1CO
InChIInChI=1S/C13H21N3O2/c1-10-11(8-17)7-14-13(15-10)18-9-12-5-3-4-6-16(12)2/h7,12,17H,3-6,8-9H2,1-2H3
InChIKeyJMMUGSCUDINJDG-UHFFFAOYSA-N
XLogP1.14
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-bromo-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidine
CID 65469032
2-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-5-amine
CID 65472450
[4-methyl-2-(1-methylpiperidin-4-yl)oxypyrimidin-5-yl]methanol
CID 83184563
(2-cyclohexyloxy-4-methylpyrimidin-5-yl)methanol
CID 83184474
2-[(1-methylpiperidin-2-yl)methoxy]pyrimidine-4-carboxylic acid
CID 107554961
[6-[(1-methylpiperidin-2-yl)methoxy]pyridazin-3-yl]methanol
CID 65467681
5-(hydroxymethyl)-2-methyl-4-[[(1-methylpiperidin-2-yl)methylamino]methyl]pyridin-3-ol
CID 116686364
[1-[(1-methylpiperidin-2-yl)methoxy]isoquinolin-3-yl]methanol
CID 65467106
[2-(cyclopentylmethoxy)-4-methylpyrimidin-5-yl]methanamine
CID 83189535
[1-[5-(hydroxymethyl)-4-methylpyrimidin-2-yl]pyrrolidin-2-yl]methanol
CID 83184365
1-[5-ethyl-6-methyl-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]pyrimidin-4-yl]azepane
CID 163223465
[4-methyl-2-(4-methylcyclohexyl)oxypyrimidin-5-yl]methanol
CID 83184911

Frequently Asked Questions

What is the IUPAC name of [4-methyl-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-5-yl]methanol?
The IUPAC name of [4-methyl-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-5-yl]methanol (CID 83184394) is [4-methyl-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-5-yl]methanol.
What is the SMILES notation for [4-methyl-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-5-yl]methanol?
The canonical SMILES for [4-methyl-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-5-yl]methanol is Cc1nc(OCC2CCCCN2C)ncc1CO.
What is the InChIKey of [4-methyl-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-5-yl]methanol?
The InChIKey is JMMUGSCUDINJDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-10-11(8-17)7-14-13(15-10)18-9-12-5-3-4-6-16(12)2/h7,12,17H,3-6,8-9H2,1-2H3.
What are the key properties of [4-methyl-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-5-yl]methanol?
[4-methyl-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-5-yl]methanol has a molecular weight of 251.33 g/mol, XLogP of 1.14, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-2-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-5-yl]methanol is sourced from PubChem (CID 83184394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).