6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-3-ol

C13H20N2O — CID 82975085

IUPAC6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-3-ol
SMILESCC1CC(C)CN(Cc2ccc(O)cn2)C1
InChIInChI=1S/C13H20N2O/c1-10-5-11(2)8-15(7-10)9-12-3-4-13(16)6-14-12/h3-4,6,10-11,16H,5,7-9H2,1-2H3
InChIKeyRMBWJOXQTTXBPZ-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.27
Rot. Bonds2

About 6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-3-ol

6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-3-ol (PubChem CID 82975085) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-3-ol.

Molecular Properties

Compound Name6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-3-ol
PubChem CID82975085
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-3-ol
SMILESCC1CC(C)CN(Cc2ccc(O)cn2)C1
InChIInChI=1S/C13H20N2O/c1-10-5-11(2)8-15(7-10)9-12-3-4-13(16)6-14-12/h3-4,6,10-11,16H,5,7-9H2,1-2H3
InChIKeyRMBWJOXQTTXBPZ-UHFFFAOYSA-N
XLogP2.27
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-3-ol?
The IUPAC name of 6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-3-ol (CID 82975085) is 6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-3-ol.
What is the SMILES notation for 6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-3-ol?
The canonical SMILES for 6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-3-ol is CC1CC(C)CN(Cc2ccc(O)cn2)C1.
What is the InChIKey of 6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-3-ol?
The InChIKey is RMBWJOXQTTXBPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-10-5-11(2)8-15(7-10)9-12-3-4-13(16)6-14-12/h3-4,6,10-11,16H,5,7-9H2,1-2H3.
What are the key properties of 6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-3-ol?
6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-3-ol has a molecular weight of 220.32 g/mol, XLogP of 2.27, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3,5-dimethylpiperidin-1-yl)methyl]pyridin-3-ol is sourced from PubChem (CID 82975085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).