2-[6-(3-methylphenyl)-3-pyridinyl]ethanol

C14H15NO — CID 117001661

IUPAC2-[6-(3-methylphenyl)-3-pyridinyl]ethanol
SMILESCc1cccc(-c2ccc(CCO)cn2)c1
InChIInChI=1S/C14H15NO/c1-11-3-2-4-13(9-11)14-6-5-12(7-8-16)10-15-14/h2-6,9-10,16H,7-8H2,1H3
InChIKeyMWYNGJVQUXYNDF-UHFFFAOYSA-N
MW213.28 g/mol
LogP2.59
Rot. Bonds3

About 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol

2-[6-(3-methylphenyl)-3-pyridinyl]ethanol (PubChem CID 117001661) has the molecular formula C14H15NO and a molecular weight of 213.28 g/mol. Its IUPAC name is 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol.

Molecular Properties

Compound Name2-[6-(3-methylphenyl)-3-pyridinyl]ethanol
PubChem CID117001661
Molecular FormulaC14H15NO
Molecular Weight213.28 g/mol
Exact Mass213.12
IUPAC Name2-[6-(3-methylphenyl)-3-pyridinyl]ethanol
SMILESCc1cccc(-c2ccc(CCO)cn2)c1
InChIInChI=1S/C14H15NO/c1-11-3-2-4-13(9-11)14-6-5-12(7-8-16)10-15-14/h2-6,9-10,16H,7-8H2,1H3
InChIKeyMWYNGJVQUXYNDF-UHFFFAOYSA-N
XLogP2.59
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol?
The IUPAC name of 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol (CID 117001661) is 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol.
What is the SMILES notation for 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol?
The canonical SMILES for 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol is Cc1cccc(-c2ccc(CCO)cn2)c1.
What is the InChIKey of 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol?
The InChIKey is MWYNGJVQUXYNDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO/c1-11-3-2-4-13(9-11)14-6-5-12(7-8-16)10-15-14/h2-6,9-10,16H,7-8H2,1H3.
What are the key properties of 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol?
2-[6-(3-methylphenyl)-3-pyridinyl]ethanol has a molecular weight of 213.28 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(3-methylphenyl)-3-pyridinyl]ethanol is sourced from PubChem (CID 117001661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).