[1-(4-ethyl-6-methylpyrimidin-2-yl)piperidin-3-yl]methanol

C13H21N3O — CID 69451869

IUPAC[1-(4-ethyl-6-methylpyrimidin-2-yl)piperidin-3-yl]methanol
SMILESCCc1cc(C)nc(N2CCCC(CO)C2)n1
InChIInChI=1S/C13H21N3O/c1-3-12-7-10(2)14-13(15-12)16-6-4-5-11(8-16)9-17/h7,11,17H,3-6,8-9H2,1-2H3
InChIKeyCIWSXZNKYNJHGT-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.56
Rot. Bonds3

About [1-(4-ethyl-6-methylpyrimidin-2-yl)piperidin-3-yl]methanol

[1-(4-ethyl-6-methylpyrimidin-2-yl)piperidin-3-yl]methanol (PubChem CID 69451869) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is [1-(4-ethyl-6-methylpyrimidin-2-yl)piperidin-3-yl]methanol.

Molecular Properties

Compound Name[1-(4-ethyl-6-methylpyrimidin-2-yl)piperidin-3-yl]methanol
PubChem CID69451869
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name[1-(4-ethyl-6-methylpyrimidin-2-yl)piperidin-3-yl]methanol
SMILESCCc1cc(C)nc(N2CCCC(CO)C2)n1
InChIInChI=1S/C13H21N3O/c1-3-12-7-10(2)14-13(15-12)16-6-4-5-11(8-16)9-17/h7,11,17H,3-6,8-9H2,1-2H3
InChIKeyCIWSXZNKYNJHGT-UHFFFAOYSA-N
XLogP1.56
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [1-(4-ethyl-6-methylpyrimidin-2-yl)piperidin-3-yl]methanol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [1-(4-ethyl-6-methylpyrimidin-2-yl)piperidin-3-yl]methanol?
The IUPAC name of [1-(4-ethyl-6-methylpyrimidin-2-yl)piperidin-3-yl]methanol (CID 69451869) is [1-(4-ethyl-6-methylpyrimidin-2-yl)piperidin-3-yl]methanol.
What is the SMILES notation for [1-(4-ethyl-6-methylpyrimidin-2-yl)piperidin-3-yl]methanol?
The canonical SMILES for [1-(4-ethyl-6-methylpyrimidin-2-yl)piperidin-3-yl]methanol is CCc1cc(C)nc(N2CCCC(CO)C2)n1.
What is the InChIKey of [1-(4-ethyl-6-methylpyrimidin-2-yl)piperidin-3-yl]methanol?
The InChIKey is CIWSXZNKYNJHGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-3-12-7-10(2)14-13(15-12)16-6-4-5-11(8-16)9-17/h7,11,17H,3-6,8-9H2,1-2H3.
What are the key properties of [1-(4-ethyl-6-methylpyrimidin-2-yl)piperidin-3-yl]methanol?
[1-(4-ethyl-6-methylpyrimidin-2-yl)piperidin-3-yl]methanol has a molecular weight of 235.33 g/mol, XLogP of 1.56, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-ethyl-6-methylpyrimidin-2-yl)piperidin-3-yl]methanol is sourced from PubChem (CID 69451869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).