4-methyl-1-pyrimidin-2-ylpiperidin-4-ol

C10H15N3O — CID 80702731

IUPAC4-methyl-1-pyrimidin-2-ylpiperidin-4-ol
SMILESCC1(O)CCN(c2ncccn2)CC1
InChIInChI=1S/C10H15N3O/c1-10(14)3-7-13(8-4-10)9-11-5-2-6-12-9/h2,5-6,14H,3-4,7-8H2,1H3
InChIKeyFJFZUPVDJOFQSE-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.83
Rot. Bonds1

About 4-methyl-1-pyrimidin-2-ylpiperidin-4-ol

4-methyl-1-pyrimidin-2-ylpiperidin-4-ol (PubChem CID 80702731) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 4-methyl-1-pyrimidin-2-ylpiperidin-4-ol.

Molecular Properties

Compound Name4-methyl-1-pyrimidin-2-ylpiperidin-4-ol
PubChem CID80702731
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name4-methyl-1-pyrimidin-2-ylpiperidin-4-ol
SMILESCC1(O)CCN(c2ncccn2)CC1
InChIInChI=1S/C10H15N3O/c1-10(14)3-7-13(8-4-10)9-11-5-2-6-12-9/h2,5-6,14H,3-4,7-8H2,1H3
InChIKeyFJFZUPVDJOFQSE-UHFFFAOYSA-N
XLogP0.83
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-pyrimidin-2-ylpiperidin-4-ol?
The IUPAC name of 4-methyl-1-pyrimidin-2-ylpiperidin-4-ol (CID 80702731) is 4-methyl-1-pyrimidin-2-ylpiperidin-4-ol.
What is the SMILES notation for 4-methyl-1-pyrimidin-2-ylpiperidin-4-ol?
The canonical SMILES for 4-methyl-1-pyrimidin-2-ylpiperidin-4-ol is CC1(O)CCN(c2ncccn2)CC1.
What is the InChIKey of 4-methyl-1-pyrimidin-2-ylpiperidin-4-ol?
The InChIKey is FJFZUPVDJOFQSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-10(14)3-7-13(8-4-10)9-11-5-2-6-12-9/h2,5-6,14H,3-4,7-8H2,1H3.
What are the key properties of 4-methyl-1-pyrimidin-2-ylpiperidin-4-ol?
4-methyl-1-pyrimidin-2-ylpiperidin-4-ol has a molecular weight of 193.25 g/mol, XLogP of 0.83, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-pyrimidin-2-ylpiperidin-4-ol is sourced from PubChem (CID 80702731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).