1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylpiperidin-4-ol

C15H24N2O2 — CID 114502552

IUPAC1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylpiperidin-4-ol
SMILESCOc1c(C)cnc(CN2CCC(O)C(C)C2)c1C
InChIInChI=1S/C15H24N2O2/c1-10-7-16-13(12(3)15(10)19-4)9-17-6-5-14(18)11(2)8-17/h7,11,14,18H,5-6,8-9H2,1-4H3
InChIKeyPDOOAURFTHBEAL-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.91
Rot. Bonds3

About 1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylpiperidin-4-ol

1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylpiperidin-4-ol (PubChem CID 114502552) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylpiperidin-4-ol
PubChem CID114502552
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylpiperidin-4-ol
SMILESCOc1c(C)cnc(CN2CCC(O)C(C)C2)c1C
InChIInChI=1S/C15H24N2O2/c1-10-7-16-13(12(3)15(10)19-4)9-17-6-5-14(18)11(2)8-17/h7,11,14,18H,5-6,8-9H2,1-4H3
InChIKeyPDOOAURFTHBEAL-UHFFFAOYSA-N
XLogP1.91
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylpiperidin-4-ol?
The IUPAC name of 1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylpiperidin-4-ol (CID 114502552) is 1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylpiperidin-4-ol.
What is the SMILES notation for 1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylpiperidin-4-ol?
The canonical SMILES for 1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylpiperidin-4-ol is COc1c(C)cnc(CN2CCC(O)C(C)C2)c1C.
What is the InChIKey of 1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylpiperidin-4-ol?
The InChIKey is PDOOAURFTHBEAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-10-7-16-13(12(3)15(10)19-4)9-17-6-5-14(18)11(2)8-17/h7,11,14,18H,5-6,8-9H2,1-4H3.
What are the key properties of 1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylpiperidin-4-ol?
1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylpiperidin-4-ol has a molecular weight of 264.37 g/mol, XLogP of 1.91, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylpiperidin-4-ol is sourced from PubChem (CID 114502552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).