6-methyl-2-(2-phenylethyl)pyridin-3-ol;hydrochloride

C14H16ClNO — CID 12004699

IUPAC6-methyl-2-(2-phenylethyl)pyridin-3-ol;hydrochloride
SMILESCc1ccc(O)c(CCc2ccccc2)n1.Cl
InChIInChI=1S/C14H15NO.ClH/c1-11-7-10-14(16)13(15-11)9-8-12-5-3-2-4-6-12;/h2-7,10,16H,8-9H2,1H3;1H
InChIKeyARPASNMOUUKDRV-UHFFFAOYSA-N
MW249.74 g/mol
LogP3.30
Rot. Bonds3

About 6-methyl-2-(2-phenylethyl)pyridin-3-ol;hydrochloride

6-methyl-2-(2-phenylethyl)pyridin-3-ol;hydrochloride (PubChem CID 12004699) has the molecular formula C14H16ClNO and a molecular weight of 249.74 g/mol. Its IUPAC name is 6-methyl-2-(2-phenylethyl)pyridin-3-ol;hydrochloride.

Molecular Properties

Compound Name6-methyl-2-(2-phenylethyl)pyridin-3-ol;hydrochloride
PubChem CID12004699
Molecular FormulaC14H16ClNO
Molecular Weight249.74 g/mol
Exact Mass249.09
IUPAC Name6-methyl-2-(2-phenylethyl)pyridin-3-ol;hydrochloride
SMILESCc1ccc(O)c(CCc2ccccc2)n1.Cl
InChIInChI=1S/C14H15NO.ClH/c1-11-7-10-14(16)13(15-11)9-8-12-5-3-2-4-6-12;/h2-7,10,16H,8-9H2,1H3;1H
InChIKeyARPASNMOUUKDRV-UHFFFAOYSA-N
XLogP3.30
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.74
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(2-phenylethyl)pyridin-3-ol;hydrochloride?
The IUPAC name of 6-methyl-2-(2-phenylethyl)pyridin-3-ol;hydrochloride (CID 12004699) is 6-methyl-2-(2-phenylethyl)pyridin-3-ol;hydrochloride.
What is the SMILES notation for 6-methyl-2-(2-phenylethyl)pyridin-3-ol;hydrochloride?
The canonical SMILES for 6-methyl-2-(2-phenylethyl)pyridin-3-ol;hydrochloride is Cc1ccc(O)c(CCc2ccccc2)n1.Cl.
What is the InChIKey of 6-methyl-2-(2-phenylethyl)pyridin-3-ol;hydrochloride?
The InChIKey is ARPASNMOUUKDRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO.ClH/c1-11-7-10-14(16)13(15-11)9-8-12-5-3-2-4-6-12;/h2-7,10,16H,8-9H2,1H3;1H.
What are the key properties of 6-methyl-2-(2-phenylethyl)pyridin-3-ol;hydrochloride?
6-methyl-2-(2-phenylethyl)pyridin-3-ol;hydrochloride has a molecular weight of 249.74 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(2-phenylethyl)pyridin-3-ol;hydrochloride is sourced from PubChem (CID 12004699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).