2-pyridin-3-yl-6-[(2R)-2-pyridin-3-ylpiperidin-1-yl]pyridin-3-ol

C20H20N4O — CID 175909114

IUPAC2-pyridin-3-yl-6-[(2R)-2-pyridin-3-ylpiperidin-1-yl]pyridin-3-ol
SMILESOc1ccc(N2CCCC[C@@H]2c2cccnc2)nc1-c1cccnc1
InChIInChI=1S/C20H20N4O/c25-18-8-9-19(23-20(18)16-6-4-11-22-14-16)24-12-2-1-7-17(24)15-5-3-10-21-13-15/h3-6,8-11,13-14,17,25H,1-2,7,12H2/t17-/m1/s1
InChIKeyUQRSRXWHLYWBRZ-QGZVFWFLSA-N
MW332.41 g/mol
LogP3.98
Rot. Bonds3

About 2-pyridin-3-yl-6-[(2R)-2-pyridin-3-ylpiperidin-1-yl]pyridin-3-ol

2-pyridin-3-yl-6-[(2R)-2-pyridin-3-ylpiperidin-1-yl]pyridin-3-ol (PubChem CID 175909114) has the molecular formula C20H20N4O and a molecular weight of 332.41 g/mol. Its IUPAC name is 2-pyridin-3-yl-6-[(2R)-2-pyridin-3-ylpiperidin-1-yl]pyridin-3-ol.

Molecular Properties

Compound Name2-pyridin-3-yl-6-[(2R)-2-pyridin-3-ylpiperidin-1-yl]pyridin-3-ol
PubChem CID175909114
Molecular FormulaC20H20N4O
Molecular Weight332.41 g/mol
Exact Mass332.16
IUPAC Name2-pyridin-3-yl-6-[(2R)-2-pyridin-3-ylpiperidin-1-yl]pyridin-3-ol
SMILESOc1ccc(N2CCCC[C@@H]2c2cccnc2)nc1-c1cccnc1
InChIInChI=1S/C20H20N4O/c25-18-8-9-19(23-20(18)16-6-4-11-22-14-16)24-12-2-1-7-17(24)15-5-3-10-21-13-15/h3-6,8-11,13-14,17,25H,1-2,7,12H2/t17-/m1/s1
InChIKeyUQRSRXWHLYWBRZ-QGZVFWFLSA-N
XLogP3.98
TPSA62.14 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.41
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-pyridin-3-yl-6-[(2R)-2-pyridin-3-ylpiperidin-1-yl]pyridin-3-ol?
The IUPAC name of 2-pyridin-3-yl-6-[(2R)-2-pyridin-3-ylpiperidin-1-yl]pyridin-3-ol (CID 175909114) is 2-pyridin-3-yl-6-[(2R)-2-pyridin-3-ylpiperidin-1-yl]pyridin-3-ol.
What is the SMILES notation for 2-pyridin-3-yl-6-[(2R)-2-pyridin-3-ylpiperidin-1-yl]pyridin-3-ol?
The canonical SMILES for 2-pyridin-3-yl-6-[(2R)-2-pyridin-3-ylpiperidin-1-yl]pyridin-3-ol is Oc1ccc(N2CCCC[C@@H]2c2cccnc2)nc1-c1cccnc1.
What is the InChIKey of 2-pyridin-3-yl-6-[(2R)-2-pyridin-3-ylpiperidin-1-yl]pyridin-3-ol?
The InChIKey is UQRSRXWHLYWBRZ-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H20N4O/c25-18-8-9-19(23-20(18)16-6-4-11-22-14-16)24-12-2-1-7-17(24)15-5-3-10-21-13-15/h3-6,8-11,13-14,17,25H,1-2,7,12H2/t17-/m1/s1.
What are the key properties of 2-pyridin-3-yl-6-[(2R)-2-pyridin-3-ylpiperidin-1-yl]pyridin-3-ol?
2-pyridin-3-yl-6-[(2R)-2-pyridin-3-ylpiperidin-1-yl]pyridin-3-ol has a molecular weight of 332.41 g/mol, XLogP of 3.98, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-3-yl-6-[(2R)-2-pyridin-3-ylpiperidin-1-yl]pyridin-3-ol is sourced from PubChem (CID 175909114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).