2-[[4-[(R)-hydroxy(phenyl)methyl]piperidin-1-yl]methyl]-6-methylpyridin-3-ol

C19H24N2O2 — CID 97332182

IUPAC2-[[4-[(R)-hydroxy(phenyl)methyl]piperidin-1-yl]methyl]-6-methylpyridin-3-ol
SMILESCc1ccc(O)c(CN2CCC([C@@H](O)c3ccccc3)CC2)n1
InChIInChI=1S/C19H24N2O2/c1-14-7-8-18(22)17(20-14)13-21-11-9-16(10-12-21)19(23)15-5-3-2-4-6-15/h2-8,16,19,22-23H,9-13H2,1H3/t19-/m0/s1
InChIKeyOBQQZIXVGAMXNM-IBGZPJMESA-N
MW312.41 g/mol
LogP3.04
Rot. Bonds4

About 2-[[4-[(R)-hydroxy(phenyl)methyl]piperidin-1-yl]methyl]-6-methylpyridin-3-ol

2-[[4-[(R)-hydroxy(phenyl)methyl]piperidin-1-yl]methyl]-6-methylpyridin-3-ol (PubChem CID 97332182) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 2-[[4-[(R)-hydroxy(phenyl)methyl]piperidin-1-yl]methyl]-6-methylpyridin-3-ol.

Molecular Properties

Compound Name2-[[4-[(R)-hydroxy(phenyl)methyl]piperidin-1-yl]methyl]-6-methylpyridin-3-ol
PubChem CID97332182
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name2-[[4-[(R)-hydroxy(phenyl)methyl]piperidin-1-yl]methyl]-6-methylpyridin-3-ol
SMILESCc1ccc(O)c(CN2CCC([C@@H](O)c3ccccc3)CC2)n1
InChIInChI=1S/C19H24N2O2/c1-14-7-8-18(22)17(20-14)13-21-11-9-16(10-12-21)19(23)15-5-3-2-4-6-15/h2-8,16,19,22-23H,9-13H2,1H3/t19-/m0/s1
InChIKeyOBQQZIXVGAMXNM-IBGZPJMESA-N
XLogP3.04
TPSA56.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[[4-[(R)-hydroxy(phenyl)methyl]piperidin-1-yl]methyl]-6-methylpyridin-3-ol?
The IUPAC name of 2-[[4-[(R)-hydroxy(phenyl)methyl]piperidin-1-yl]methyl]-6-methylpyridin-3-ol (CID 97332182) is 2-[[4-[(R)-hydroxy(phenyl)methyl]piperidin-1-yl]methyl]-6-methylpyridin-3-ol.
What is the SMILES notation for 2-[[4-[(R)-hydroxy(phenyl)methyl]piperidin-1-yl]methyl]-6-methylpyridin-3-ol?
The canonical SMILES for 2-[[4-[(R)-hydroxy(phenyl)methyl]piperidin-1-yl]methyl]-6-methylpyridin-3-ol is Cc1ccc(O)c(CN2CCC([C@@H](O)c3ccccc3)CC2)n1.
What is the InChIKey of 2-[[4-[(R)-hydroxy(phenyl)methyl]piperidin-1-yl]methyl]-6-methylpyridin-3-ol?
The InChIKey is OBQQZIXVGAMXNM-IBGZPJMESA-N. The full InChI is InChI=1S/C19H24N2O2/c1-14-7-8-18(22)17(20-14)13-21-11-9-16(10-12-21)19(23)15-5-3-2-4-6-15/h2-8,16,19,22-23H,9-13H2,1H3/t19-/m0/s1.
What are the key properties of 2-[[4-[(R)-hydroxy(phenyl)methyl]piperidin-1-yl]methyl]-6-methylpyridin-3-ol?
2-[[4-[(R)-hydroxy(phenyl)methyl]piperidin-1-yl]methyl]-6-methylpyridin-3-ol has a molecular weight of 312.41 g/mol, XLogP of 3.04, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-[(R)-hydroxy(phenyl)methyl]piperidin-1-yl]methyl]-6-methylpyridin-3-ol is sourced from PubChem (CID 97332182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).