(4-methoxy-3-methyl-5-phenylmethoxy-2-pyridinyl)methanol

C15H17NO3 — CID 54539942

IUPAC(4-methoxy-3-methyl-5-phenylmethoxy-2-pyridinyl)methanol
SMILESCOc1c(OCc2ccccc2)cnc(CO)c1C
InChIInChI=1S/C15H17NO3/c1-11-13(9-17)16-8-14(15(11)18-2)19-10-12-6-4-3-5-7-12/h3-8,17H,9-10H2,1-2H3
InChIKeyZCLCITKUPIROGH-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.47
Rot. Bonds5

About (4-methoxy-3-methyl-5-phenylmethoxy-2-pyridinyl)methanol

(4-methoxy-3-methyl-5-phenylmethoxy-2-pyridinyl)methanol (PubChem CID 54539942) has the molecular formula C15H17NO3 and a molecular weight of 259.31 g/mol. Its IUPAC name is (4-methoxy-3-methyl-5-phenylmethoxy-2-pyridinyl)methanol.

Molecular Properties

Compound Name(4-methoxy-3-methyl-5-phenylmethoxy-2-pyridinyl)methanol
PubChem CID54539942
Molecular FormulaC15H17NO3
Molecular Weight259.31 g/mol
Exact Mass259.12
IUPAC Name(4-methoxy-3-methyl-5-phenylmethoxy-2-pyridinyl)methanol
SMILESCOc1c(OCc2ccccc2)cnc(CO)c1C
InChIInChI=1S/C15H17NO3/c1-11-13(9-17)16-8-14(15(11)18-2)19-10-12-6-4-3-5-7-12/h3-8,17H,9-10H2,1-2H3
InChIKeyZCLCITKUPIROGH-UHFFFAOYSA-N
XLogP2.47
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 ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3-methyl-4-phenylmethoxyquinolin-2-yl)methanol
CID 68508380
[3,4-bis(phenylmethoxy)-2-pyridinyl]methanol
CID 11324699
6-chloro-3-methoxy-2-methyl-4-phenylmethoxypyridine
CID 169250017
(2-methyl-3-phenylmethoxyphenyl)methanol
CID 58087471
(4,5-dimethoxy-2-phenylmethoxyphenyl)methanol
CID 53441132
ethane;(2-methyl-3-phenylmethoxyphenyl)methanol
CID 143384106
1-iodo-4,5-dimethoxy-3-methyl-2-phenylmethoxybenzene
CID 11143485
3,4-dimethyl-5-phenylmethoxypyridine
CID 70023630
4-[2-(5,6-dimethoxy-3-methyl-4-phenylmethoxy-2-pyridinyl)ethyl]phenol
CID 58625510
(4,5-dimethoxy-3-methyl-2-pyridinyl)methanethiol
CID 174259163
1,4-dimethoxy-2,3,5-trimethyl-6-[(2-phenylmethoxyphenyl)methyl]benzene
CID 139821810
2-bromo-4-ethyl-3-methyl-5-phenylmethoxypyridine
CID 90979990

Frequently Asked Questions

What is the IUPAC name of (4-methoxy-3-methyl-5-phenylmethoxy-2-pyridinyl)methanol?
The IUPAC name of (4-methoxy-3-methyl-5-phenylmethoxy-2-pyridinyl)methanol (CID 54539942) is (4-methoxy-3-methyl-5-phenylmethoxy-2-pyridinyl)methanol.
What is the SMILES notation for (4-methoxy-3-methyl-5-phenylmethoxy-2-pyridinyl)methanol?
The canonical SMILES for (4-methoxy-3-methyl-5-phenylmethoxy-2-pyridinyl)methanol is COc1c(OCc2ccccc2)cnc(CO)c1C.
What is the InChIKey of (4-methoxy-3-methyl-5-phenylmethoxy-2-pyridinyl)methanol?
The InChIKey is ZCLCITKUPIROGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3/c1-11-13(9-17)16-8-14(15(11)18-2)19-10-12-6-4-3-5-7-12/h3-8,17H,9-10H2,1-2H3.
What are the key properties of (4-methoxy-3-methyl-5-phenylmethoxy-2-pyridinyl)methanol?
(4-methoxy-3-methyl-5-phenylmethoxy-2-pyridinyl)methanol has a molecular weight of 259.31 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxy-3-methyl-5-phenylmethoxy-2-pyridinyl)methanol is sourced from PubChem (CID 54539942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).