2-[5-(2-methyl-6-phenylmethoxy-3-pyridinyl)-2-pyridinyl]ethanol

C20H20N2O2 — CID 170129555

IUPAC2-[5-(2-methyl-6-phenylmethoxy-3-pyridinyl)-2-pyridinyl]ethanol
SMILESCc1nc(OCc2ccccc2)ccc1-c1ccc(CCO)nc1
InChIInChI=1S/C20H20N2O2/c1-15-19(17-7-8-18(11-12-23)21-13-17)9-10-20(22-15)24-14-16-5-3-2-4-6-16/h2-10,13,23H,11-12,14H2,1H3
InChIKeyYPVROBKEQZMHAR-UHFFFAOYSA-N
MW320.39 g/mol
LogP3.57
Rot. Bonds6

About 2-[5-(2-methyl-6-phenylmethoxy-3-pyridinyl)-2-pyridinyl]ethanol

2-[5-(2-methyl-6-phenylmethoxy-3-pyridinyl)-2-pyridinyl]ethanol (PubChem CID 170129555) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is 2-[5-(2-methyl-6-phenylmethoxy-3-pyridinyl)-2-pyridinyl]ethanol.

Molecular Properties

Compound Name2-[5-(2-methyl-6-phenylmethoxy-3-pyridinyl)-2-pyridinyl]ethanol
PubChem CID170129555
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC Name2-[5-(2-methyl-6-phenylmethoxy-3-pyridinyl)-2-pyridinyl]ethanol
SMILESCc1nc(OCc2ccccc2)ccc1-c1ccc(CCO)nc1
InChIInChI=1S/C20H20N2O2/c1-15-19(17-7-8-18(11-12-23)21-13-17)9-10-20(22-15)24-14-16-5-3-2-4-6-16/h2-10,13,23H,11-12,14H2,1H3
InChIKeyYPVROBKEQZMHAR-UHFFFAOYSA-N
XLogP3.57
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(2-methyl-6-phenylmethoxy-3-pyridinyl)-2-pyridinyl]ethanol?
The IUPAC name of 2-[5-(2-methyl-6-phenylmethoxy-3-pyridinyl)-2-pyridinyl]ethanol (CID 170129555) is 2-[5-(2-methyl-6-phenylmethoxy-3-pyridinyl)-2-pyridinyl]ethanol.
What is the SMILES notation for 2-[5-(2-methyl-6-phenylmethoxy-3-pyridinyl)-2-pyridinyl]ethanol?
The canonical SMILES for 2-[5-(2-methyl-6-phenylmethoxy-3-pyridinyl)-2-pyridinyl]ethanol is Cc1nc(OCc2ccccc2)ccc1-c1ccc(CCO)nc1.
What is the InChIKey of 2-[5-(2-methyl-6-phenylmethoxy-3-pyridinyl)-2-pyridinyl]ethanol?
The InChIKey is YPVROBKEQZMHAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2/c1-15-19(17-7-8-18(11-12-23)21-13-17)9-10-20(22-15)24-14-16-5-3-2-4-6-16/h2-10,13,23H,11-12,14H2,1H3.
What are the key properties of 2-[5-(2-methyl-6-phenylmethoxy-3-pyridinyl)-2-pyridinyl]ethanol?
2-[5-(2-methyl-6-phenylmethoxy-3-pyridinyl)-2-pyridinyl]ethanol has a molecular weight of 320.39 g/mol, XLogP of 3.57, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(2-methyl-6-phenylmethoxy-3-pyridinyl)-2-pyridinyl]ethanol is sourced from PubChem (CID 170129555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).