(3R)-1-(6-ethyl-3-pyridinyl)-3-(morpholin-4-ylmethyl)piperidin-3-ol

C17H27N3O2 — CID 167295536

IUPAC(3R)-1-(6-ethyl-3-pyridinyl)-3-(morpholin-4-ylmethyl)piperidin-3-ol
SMILESCCc1ccc(N2CCC[C@@](O)(CN3CCOCC3)C2)cn1
InChIInChI=1S/C17H27N3O2/c1-2-15-4-5-16(12-18-15)20-7-3-6-17(21,14-20)13-19-8-10-22-11-9-19/h4-5,12,21H,2-3,6-11,13-14H2,1H3/t17-/m1/s1
InChIKeyZOKCSJVPBJURMI-QGZVFWFLSA-N
MW305.42 g/mol
LogP1.31
Rot. Bonds4

About (3R)-1-(6-ethyl-3-pyridinyl)-3-(morpholin-4-ylmethyl)piperidin-3-ol

(3R)-1-(6-ethyl-3-pyridinyl)-3-(morpholin-4-ylmethyl)piperidin-3-ol (PubChem CID 167295536) has the molecular formula C17H27N3O2 and a molecular weight of 305.42 g/mol. Its IUPAC name is (3R)-1-(6-ethyl-3-pyridinyl)-3-(morpholin-4-ylmethyl)piperidin-3-ol.

Molecular Properties

Compound Name(3R)-1-(6-ethyl-3-pyridinyl)-3-(morpholin-4-ylmethyl)piperidin-3-ol
PubChem CID167295536
Molecular FormulaC17H27N3O2
Molecular Weight305.42 g/mol
Exact Mass305.21
IUPAC Name(3R)-1-(6-ethyl-3-pyridinyl)-3-(morpholin-4-ylmethyl)piperidin-3-ol
SMILESCCc1ccc(N2CCC[C@@](O)(CN3CCOCC3)C2)cn1
InChIInChI=1S/C17H27N3O2/c1-2-15-4-5-16(12-18-15)20-7-3-6-17(21,14-20)13-19-8-10-22-11-9-19/h4-5,12,21H,2-3,6-11,13-14H2,1H3/t17-/m1/s1
InChIKeyZOKCSJVPBJURMI-QGZVFWFLSA-N
XLogP1.31
TPSA48.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.42
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (3R)-1-(6-ethyl-3-pyridinyl)-3-(morpholin-4-ylmethyl)piperidin-3-ol?
The IUPAC name of (3R)-1-(6-ethyl-3-pyridinyl)-3-(morpholin-4-ylmethyl)piperidin-3-ol (CID 167295536) is (3R)-1-(6-ethyl-3-pyridinyl)-3-(morpholin-4-ylmethyl)piperidin-3-ol.
What is the SMILES notation for (3R)-1-(6-ethyl-3-pyridinyl)-3-(morpholin-4-ylmethyl)piperidin-3-ol?
The canonical SMILES for (3R)-1-(6-ethyl-3-pyridinyl)-3-(morpholin-4-ylmethyl)piperidin-3-ol is CCc1ccc(N2CCC[C@@](O)(CN3CCOCC3)C2)cn1.
What is the InChIKey of (3R)-1-(6-ethyl-3-pyridinyl)-3-(morpholin-4-ylmethyl)piperidin-3-ol?
The InChIKey is ZOKCSJVPBJURMI-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H27N3O2/c1-2-15-4-5-16(12-18-15)20-7-3-6-17(21,14-20)13-19-8-10-22-11-9-19/h4-5,12,21H,2-3,6-11,13-14H2,1H3/t17-/m1/s1.
What are the key properties of (3R)-1-(6-ethyl-3-pyridinyl)-3-(morpholin-4-ylmethyl)piperidin-3-ol?
(3R)-1-(6-ethyl-3-pyridinyl)-3-(morpholin-4-ylmethyl)piperidin-3-ol has a molecular weight of 305.42 g/mol, XLogP of 1.31, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(6-ethyl-3-pyridinyl)-3-(morpholin-4-ylmethyl)piperidin-3-ol is sourced from PubChem (CID 167295536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).