[2-[(2,5-dimethoxyphenyl)methyl]-3-pyridinyl]methanol

C15H17NO3 — CID 10658939

IUPAC[2-[(2,5-dimethoxyphenyl)methyl]-3-pyridinyl]methanol
SMILESCOc1ccc(OC)c(Cc2ncccc2CO)c1
InChIInChI=1S/C15H17NO3/c1-18-13-5-6-15(19-2)12(8-13)9-14-11(10-17)4-3-7-16-14/h3-8,17H,9-10H2,1-2H3
InChIKeyBJQQSGXWRCZCFT-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.18
Rot. Bonds5

About [2-[(2,5-dimethoxyphenyl)methyl]-3-pyridinyl]methanol

[2-[(2,5-dimethoxyphenyl)methyl]-3-pyridinyl]methanol (PubChem CID 10658939) has the molecular formula C15H17NO3 and a molecular weight of 259.31 g/mol. Its IUPAC name is [2-[(2,5-dimethoxyphenyl)methyl]-3-pyridinyl]methanol.

Molecular Properties

Compound Name[2-[(2,5-dimethoxyphenyl)methyl]-3-pyridinyl]methanol
PubChem CID10658939
Molecular FormulaC15H17NO3
Molecular Weight259.31 g/mol
Exact Mass259.12
IUPAC Name[2-[(2,5-dimethoxyphenyl)methyl]-3-pyridinyl]methanol
SMILESCOc1ccc(OC)c(Cc2ncccc2CO)c1
InChIInChI=1S/C15H17NO3/c1-18-13-5-6-15(19-2)12(8-13)9-14-11(10-17)4-3-7-16-14/h3-8,17H,9-10H2,1-2H3
InChIKeyBJQQSGXWRCZCFT-UHFFFAOYSA-N
XLogP2.18
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-[(3,4-dimethoxyphenyl)methyl]-2-pyridinyl]methanol
CID 54192940
N-[(2,5-dimethoxyphenyl)methyl]-1-(2-methoxy-3-pyridinyl)methanamine
CID 60761595
2-[(2-chloro-3-pyridinyl)methyl-[(2,5-dimethoxyphenyl)methyl]amino]ethanol
CID 111113631
[2-(3,4-dimethoxyphenyl)-3-pyridinyl]methanol
CID 54102100
[2-(3,5-dimethoxy-4-methylphenyl)-3-pyridinyl]methanol
CID 142818156
(5-ethoxy-2-methoxyphenyl)methanol
CID 82643938
[5-methoxy-2-(2,2,2-trifluoroethoxy)phenyl]methanol
CID 43268000
[3-(3,4-dimethoxyphenyl)-2-pyridinyl]methanol
CID 54504327
2-methoxy-6-[(6-methoxyisoquinolin-1-yl)methyl]phenol
CID 626378
[2-(3,4,5-trimethoxyphenyl)-3-pyridinyl]methanol
CID 22557920
[3-[(2-bromo-4-methoxyphenoxy)methyl]-2-pyridinyl]methanamine
CID 104706871
[2-[(2-bromophenyl)methoxy]-5-methoxyphenyl]methanol
CID 43267977

Frequently Asked Questions

What is the IUPAC name of [2-[(2,5-dimethoxyphenyl)methyl]-3-pyridinyl]methanol?
The IUPAC name of [2-[(2,5-dimethoxyphenyl)methyl]-3-pyridinyl]methanol (CID 10658939) is [2-[(2,5-dimethoxyphenyl)methyl]-3-pyridinyl]methanol.
What is the SMILES notation for [2-[(2,5-dimethoxyphenyl)methyl]-3-pyridinyl]methanol?
The canonical SMILES for [2-[(2,5-dimethoxyphenyl)methyl]-3-pyridinyl]methanol is COc1ccc(OC)c(Cc2ncccc2CO)c1.
What is the InChIKey of [2-[(2,5-dimethoxyphenyl)methyl]-3-pyridinyl]methanol?
The InChIKey is BJQQSGXWRCZCFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3/c1-18-13-5-6-15(19-2)12(8-13)9-14-11(10-17)4-3-7-16-14/h3-8,17H,9-10H2,1-2H3.
What are the key properties of [2-[(2,5-dimethoxyphenyl)methyl]-3-pyridinyl]methanol?
[2-[(2,5-dimethoxyphenyl)methyl]-3-pyridinyl]methanol has a molecular weight of 259.31 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2,5-dimethoxyphenyl)methyl]-3-pyridinyl]methanol is sourced from PubChem (CID 10658939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).