[2-(3,4-dimethoxyphenyl)-3-pyridinyl]methanol

C14H15NO3 — CID 54102100

IUPAC[2-(3,4-dimethoxyphenyl)-3-pyridinyl]methanol
SMILESCOc1ccc(-c2ncccc2CO)cc1OC
InChIInChI=1S/C14H15NO3/c1-17-12-6-5-10(8-13(12)18-2)14-11(9-16)4-3-7-15-14/h3-8,16H,9H2,1-2H3
InChIKeyNBEYFDNCYZVJJN-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.26
Rot. Bonds4

About [2-(3,4-dimethoxyphenyl)-3-pyridinyl]methanol

[2-(3,4-dimethoxyphenyl)-3-pyridinyl]methanol (PubChem CID 54102100) has the molecular formula C14H15NO3 and a molecular weight of 245.28 g/mol. Its IUPAC name is [2-(3,4-dimethoxyphenyl)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[2-(3,4-dimethoxyphenyl)-3-pyridinyl]methanol
PubChem CID54102100
Molecular FormulaC14H15NO3
Molecular Weight245.28 g/mol
Exact Mass245.11
IUPAC Name[2-(3,4-dimethoxyphenyl)-3-pyridinyl]methanol
SMILESCOc1ccc(-c2ncccc2CO)cc1OC
InChIInChI=1S/C14H15NO3/c1-17-12-6-5-10(8-13(12)18-2)14-11(9-16)4-3-7-15-14/h3-8,16H,9H2,1-2H3
InChIKeyNBEYFDNCYZVJJN-UHFFFAOYSA-N
XLogP2.26
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(3,4,5-trimethoxyphenyl)-3-pyridinyl]methanol
CID 22557920
[2-(3,5-dimethoxy-4-methylphenyl)-3-pyridinyl]methanol
CID 142818156
[3-(3,4-dimethoxyphenyl)-2-pyridinyl]methanol
CID 54504327
2-(3,4-dimethoxyphenyl)pyridin-3-amine
CID 23075532
2-[4-(hydroxymethyl)-3-methoxyphenyl]pyridine-3-carboxylic acid
CID 57210364
[3-[(3,4-dimethoxyphenyl)methyl]-2-pyridinyl]methanol
CID 54192940
3-[2-(3,4,5-trimethoxyphenyl)-3-pyridinyl]propan-1-ol
CID 18674981
2-chloro-3-(3,4-dimethoxyphenyl)pyridine
CID 82087270
[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]methanol
CID 883556
[2-(4-fluorophenyl)-3-pyridinyl]methanol
CID 22158045
1-[2-(cyclopropylmethoxy)-5-[3-(hydroxymethyl)-2-pyridinyl]phenyl]ethanone
CID 123689350
2-[2-(3-methoxyphenyl)-3-pyridinyl]ethanol
CID 117001607

Frequently Asked Questions

What is the IUPAC name of [2-(3,4-dimethoxyphenyl)-3-pyridinyl]methanol?
The IUPAC name of [2-(3,4-dimethoxyphenyl)-3-pyridinyl]methanol (CID 54102100) is [2-(3,4-dimethoxyphenyl)-3-pyridinyl]methanol.
What is the SMILES notation for [2-(3,4-dimethoxyphenyl)-3-pyridinyl]methanol?
The canonical SMILES for [2-(3,4-dimethoxyphenyl)-3-pyridinyl]methanol is COc1ccc(-c2ncccc2CO)cc1OC.
What is the InChIKey of [2-(3,4-dimethoxyphenyl)-3-pyridinyl]methanol?
The InChIKey is NBEYFDNCYZVJJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO3/c1-17-12-6-5-10(8-13(12)18-2)14-11(9-16)4-3-7-15-14/h3-8,16H,9H2,1-2H3.
What are the key properties of [2-(3,4-dimethoxyphenyl)-3-pyridinyl]methanol?
[2-(3,4-dimethoxyphenyl)-3-pyridinyl]methanol has a molecular weight of 245.28 g/mol, XLogP of 2.26, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3,4-dimethoxyphenyl)-3-pyridinyl]methanol is sourced from PubChem (CID 54102100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).