4-methyl-1-(2-methylpyrimidin-4-yl)piperidin-3-ol

C11H17N3O — CID 103896105

IUPAC4-methyl-1-(2-methylpyrimidin-4-yl)piperidin-3-ol
SMILESCc1nccc(N2CCC(C)C(O)C2)n1
InChIInChI=1S/C11H17N3O/c1-8-4-6-14(7-10(8)15)11-3-5-12-9(2)13-11/h3,5,8,10,15H,4,6-7H2,1-2H3
InChIKeyGQSHIMHEMYPNQX-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.99
Rot. Bonds1

About 4-methyl-1-(2-methylpyrimidin-4-yl)piperidin-3-ol

4-methyl-1-(2-methylpyrimidin-4-yl)piperidin-3-ol (PubChem CID 103896105) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 4-methyl-1-(2-methylpyrimidin-4-yl)piperidin-3-ol.

Molecular Properties

Compound Name4-methyl-1-(2-methylpyrimidin-4-yl)piperidin-3-ol
PubChem CID103896105
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name4-methyl-1-(2-methylpyrimidin-4-yl)piperidin-3-ol
SMILESCc1nccc(N2CCC(C)C(O)C2)n1
InChIInChI=1S/C11H17N3O/c1-8-4-6-14(7-10(8)15)11-3-5-12-9(2)13-11/h3,5,8,10,15H,4,6-7H2,1-2H3
InChIKeyGQSHIMHEMYPNQX-UHFFFAOYSA-N
XLogP0.99
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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1-[1-(2-methylpyrimidin-4-yl)pyrrolidin-3-yl]ethanamine
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N-methyl-1-(2-methylpyrimidin-4-yl)-N-phenylpyrrolidin-3-amine
CID 136553102
1,1,3-trimethyl-3-[1-(2-methylpyrimidin-4-yl)piperidin-4-yl]urea
CID 166603310
2-methyl-4-(4-phenylpiperidin-1-yl)pyrimidine
CID 136528453
1-[6-(hydroxymethyl)-2-pyridinyl]-4-methylpiperidin-3-ol
CID 102964194
1-(2-methylpyrimidin-4-yl)azepane
CID 126972484
1-[4-[1-(ethylamino)ethyl]-2-pyridinyl]-4-methylpiperidin-3-ol
CID 102958933
(1R,5S)-3-(2-methylpyrimidin-4-yl)-3-azabicyclo[3.2.1]octan-8-amine
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[3-methyl-1-(2-methylpyrimidin-4-yl)pyrrolidin-2-yl]methanamine
CID 102783996
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CID 86777943

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(2-methylpyrimidin-4-yl)piperidin-3-ol?
The IUPAC name of 4-methyl-1-(2-methylpyrimidin-4-yl)piperidin-3-ol (CID 103896105) is 4-methyl-1-(2-methylpyrimidin-4-yl)piperidin-3-ol.
What is the SMILES notation for 4-methyl-1-(2-methylpyrimidin-4-yl)piperidin-3-ol?
The canonical SMILES for 4-methyl-1-(2-methylpyrimidin-4-yl)piperidin-3-ol is Cc1nccc(N2CCC(C)C(O)C2)n1.
What is the InChIKey of 4-methyl-1-(2-methylpyrimidin-4-yl)piperidin-3-ol?
The InChIKey is GQSHIMHEMYPNQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-8-4-6-14(7-10(8)15)11-3-5-12-9(2)13-11/h3,5,8,10,15H,4,6-7H2,1-2H3.
What are the key properties of 4-methyl-1-(2-methylpyrimidin-4-yl)piperidin-3-ol?
4-methyl-1-(2-methylpyrimidin-4-yl)piperidin-3-ol has a molecular weight of 207.28 g/mol, XLogP of 0.99, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(2-methylpyrimidin-4-yl)piperidin-3-ol is sourced from PubChem (CID 103896105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).