[3-(3-methylphenyl)-4-pyridinyl]methanol

C13H13NO — CID 130118995

IUPAC[3-(3-methylphenyl)-4-pyridinyl]methanol
SMILESCc1cccc(-c2cnccc2CO)c1
InChIInChI=1S/C13H13NO/c1-10-3-2-4-11(7-10)13-8-14-6-5-12(13)9-15/h2-8,15H,9H2,1H3
InChIKeyCNWYKMYVGVTGJZ-UHFFFAOYSA-N
MW199.25 g/mol
LogP2.55
Rot. Bonds2

About [3-(3-methylphenyl)-4-pyridinyl]methanol

[3-(3-methylphenyl)-4-pyridinyl]methanol (PubChem CID 130118995) has the molecular formula C13H13NO and a molecular weight of 199.25 g/mol. Its IUPAC name is [3-(3-methylphenyl)-4-pyridinyl]methanol.

Molecular Properties

Compound Name[3-(3-methylphenyl)-4-pyridinyl]methanol
PubChem CID130118995
Molecular FormulaC13H13NO
Molecular Weight199.25 g/mol
Exact Mass199.10
IUPAC Name[3-(3-methylphenyl)-4-pyridinyl]methanol
SMILESCc1cccc(-c2cnccc2CO)c1
InChIInChI=1S/C13H13NO/c1-10-3-2-4-11(7-10)13-8-14-6-5-12(13)9-15/h2-8,15H,9H2,1H3
InChIKeyCNWYKMYVGVTGJZ-UHFFFAOYSA-N
XLogP2.55
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [3-(3-methylphenyl)-4-pyridinyl]methanol?
The IUPAC name of [3-(3-methylphenyl)-4-pyridinyl]methanol (CID 130118995) is [3-(3-methylphenyl)-4-pyridinyl]methanol.
What is the SMILES notation for [3-(3-methylphenyl)-4-pyridinyl]methanol?
The canonical SMILES for [3-(3-methylphenyl)-4-pyridinyl]methanol is Cc1cccc(-c2cnccc2CO)c1.
What is the InChIKey of [3-(3-methylphenyl)-4-pyridinyl]methanol?
The InChIKey is CNWYKMYVGVTGJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO/c1-10-3-2-4-11(7-10)13-8-14-6-5-12(13)9-15/h2-8,15H,9H2,1H3.
What are the key properties of [3-(3-methylphenyl)-4-pyridinyl]methanol?
[3-(3-methylphenyl)-4-pyridinyl]methanol has a molecular weight of 199.25 g/mol, XLogP of 2.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(3-methylphenyl)-4-pyridinyl]methanol is sourced from PubChem (CID 130118995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).