[3,4-bis(phenylmethoxy)-2-pyridinyl]methanol

C20H19NO3 — CID 11324699

IUPAC[3,4-bis(phenylmethoxy)-2-pyridinyl]methanol
SMILESOCc1nccc(OCc2ccccc2)c1OCc1ccccc1
InChIInChI=1S/C20H19NO3/c22-13-18-20(24-15-17-9-5-2-6-10-17)19(11-12-21-18)23-14-16-7-3-1-4-8-16/h1-12,22H,13-15H2
InChIKeyZKUSSRUNWULMLA-UHFFFAOYSA-N
MW321.38 g/mol
LogP3.73
Rot. Bonds7

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

[3,4-bis(phenylmethoxy)-2-pyridinyl]methanol (PubChem CID 11324699) has the molecular formula C20H19NO3 and a molecular weight of 321.38 g/mol. Its IUPAC name is [3,4-bis(phenylmethoxy)-2-pyridinyl]methanol.

Molecular Properties

Compound Name[3,4-bis(phenylmethoxy)-2-pyridinyl]methanol
PubChem CID11324699
Molecular FormulaC20H19NO3
Molecular Weight321.38 g/mol
Exact Mass321.14
IUPAC Name[3,4-bis(phenylmethoxy)-2-pyridinyl]methanol
SMILESOCc1nccc(OCc2ccccc2)c1OCc1ccccc1
InChIInChI=1S/C20H19NO3/c22-13-18-20(24-15-17-9-5-2-6-10-17)19(11-12-21-18)23-14-16-7-3-1-4-8-16/h1-12,22H,13-15H2
InChIKeyZKUSSRUNWULMLA-UHFFFAOYSA-N
XLogP3.73
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4,7-bis(phenylmethoxy)-1,10-phenanthroline
CID 23134911
4-phenylmethoxyquinoline
CID 11299312
3,4-bis(phenylmethoxy)pyridine-2-carbaldehyde
CID 23245667
N'-[(4-methoxy-3-phenylmethoxy-2-pyridinyl)methyl]-N-[2-[(4-methoxy-3-phenylmethoxy-2-pyridinyl)methylamino]ethyl]ethane-1,2-diamine
CID 67814371
N-(2-hydroxyethyl)-3,4-bis(phenylmethoxy)pyridine-2-carboxamide
CID 23245673
(4-methoxy-3-methyl-5-phenylmethoxy-2-pyridinyl)methanol
CID 54539942
(3-methyl-4-phenylmethoxyquinolin-2-yl)methanol
CID 68508380
6-fluoro-4-phenylmethoxyquinoline
CID 164587586
6-bromo-8-methoxy-4-phenylmethoxyquinoline
CID 178032922
1,2-bis(phenylmethoxy)naphthalene
CID 67710722
3-iodo-2,4-bis(phenylmethoxy)pyridine
CID 166168867
[3-bromo-4,5-bis(phenylmethoxy)phenyl]methanol
CID 10431016

Frequently Asked Questions

What is the IUPAC name of [3,4-bis(phenylmethoxy)-2-pyridinyl]methanol?
The IUPAC name of [3,4-bis(phenylmethoxy)-2-pyridinyl]methanol (CID 11324699) is [3,4-bis(phenylmethoxy)-2-pyridinyl]methanol.
What is the SMILES notation for [3,4-bis(phenylmethoxy)-2-pyridinyl]methanol?
The canonical SMILES for [3,4-bis(phenylmethoxy)-2-pyridinyl]methanol is OCc1nccc(OCc2ccccc2)c1OCc1ccccc1.
What is the InChIKey of [3,4-bis(phenylmethoxy)-2-pyridinyl]methanol?
The InChIKey is ZKUSSRUNWULMLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO3/c22-13-18-20(24-15-17-9-5-2-6-10-17)19(11-12-21-18)23-14-16-7-3-1-4-8-16/h1-12,22H,13-15H2.
What are the key properties of [3,4-bis(phenylmethoxy)-2-pyridinyl]methanol?
[3,4-bis(phenylmethoxy)-2-pyridinyl]methanol has a molecular weight of 321.38 g/mol, XLogP of 3.73, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3,4-bis(phenylmethoxy)-2-pyridinyl]methanol is sourced from PubChem (CID 11324699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).