3-[methyl-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]amino]propan-1-ol

C15H25N3O — CID 86797239

IUPAC3-[methyl-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]amino]propan-1-ol
SMILESCc1cccc(N2CCC(N(C)CCCO)CC2)n1
InChIInChI=1S/C15H25N3O/c1-13-5-3-6-15(16-13)18-10-7-14(8-11-18)17(2)9-4-12-19/h3,5-6,14,19H,4,7-12H2,1-2H3
InChIKeyXWJGPKSQYFOEPV-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.67
Rot. Bonds5

About 3-[methyl-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]amino]propan-1-ol

3-[methyl-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]amino]propan-1-ol (PubChem CID 86797239) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 3-[methyl-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]amino]propan-1-ol.

Molecular Properties

Compound Name3-[methyl-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]amino]propan-1-ol
PubChem CID86797239
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name3-[methyl-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]amino]propan-1-ol
SMILESCc1cccc(N2CCC(N(C)CCCO)CC2)n1
InChIInChI=1S/C15H25N3O/c1-13-5-3-6-15(16-13)18-10-7-14(8-11-18)17(2)9-4-12-19/h3,5-6,14,19H,4,7-12H2,1-2H3
InChIKeyXWJGPKSQYFOEPV-UHFFFAOYSA-N
XLogP1.67
TPSA39.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[methyl-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]amino]propan-1-ol?
The IUPAC name of 3-[methyl-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]amino]propan-1-ol (CID 86797239) is 3-[methyl-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]amino]propan-1-ol.
What is the SMILES notation for 3-[methyl-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]amino]propan-1-ol?
The canonical SMILES for 3-[methyl-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]amino]propan-1-ol is Cc1cccc(N2CCC(N(C)CCCO)CC2)n1.
What is the InChIKey of 3-[methyl-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]amino]propan-1-ol?
The InChIKey is XWJGPKSQYFOEPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-13-5-3-6-15(16-13)18-10-7-14(8-11-18)17(2)9-4-12-19/h3,5-6,14,19H,4,7-12H2,1-2H3.
What are the key properties of 3-[methyl-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]amino]propan-1-ol?
3-[methyl-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]amino]propan-1-ol has a molecular weight of 263.38 g/mol, XLogP of 1.67, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methyl-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]amino]propan-1-ol is sourced from PubChem (CID 86797239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).