[3-[(2,4-dichlorophenyl)methoxy]-6-methyl-2-pyridinyl]methanol

C14H13Cl2NO2 — CID 79157833

IUPAC[3-[(2,4-dichlorophenyl)methoxy]-6-methyl-2-pyridinyl]methanol
SMILESCc1ccc(OCc2ccc(Cl)cc2Cl)c(CO)n1
InChIInChI=1S/C14H13Cl2NO2/c1-9-2-5-14(13(7-18)17-9)19-8-10-3-4-11(15)6-12(10)16/h2-6,18H,7-8H2,1H3
InChIKeyRKNHEGAYFAXUJI-UHFFFAOYSA-N
MW298.17 g/mol
LogP3.77
Rot. Bonds4

About [3-[(2,4-dichlorophenyl)methoxy]-6-methyl-2-pyridinyl]methanol

[3-[(2,4-dichlorophenyl)methoxy]-6-methyl-2-pyridinyl]methanol (PubChem CID 79157833) has the molecular formula C14H13Cl2NO2 and a molecular weight of 298.17 g/mol. Its IUPAC name is [3-[(2,4-dichlorophenyl)methoxy]-6-methyl-2-pyridinyl]methanol.

Molecular Properties

Compound Name[3-[(2,4-dichlorophenyl)methoxy]-6-methyl-2-pyridinyl]methanol
PubChem CID79157833
Molecular FormulaC14H13Cl2NO2
Molecular Weight298.17 g/mol
Exact Mass297.03
IUPAC Name[3-[(2,4-dichlorophenyl)methoxy]-6-methyl-2-pyridinyl]methanol
SMILESCc1ccc(OCc2ccc(Cl)cc2Cl)c(CO)n1
InChIInChI=1S/C14H13Cl2NO2/c1-9-2-5-14(13(7-18)17-9)19-8-10-3-4-11(15)6-12(10)16/h2-6,18H,7-8H2,1H3
InChIKeyRKNHEGAYFAXUJI-UHFFFAOYSA-N
XLogP3.77
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.17
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-[(5-chloro-2-nitrophenyl)methoxy]-6-methyl-2-pyridinyl]methanol
CID 79557329
[6-methyl-3-(pyrimidin-2-ylmethoxy)-2-pyridinyl]methanol
CID 79158019
[6-methyl-3-[(4-methyl-1,2,5-oxadiazol-3-yl)methoxy]-2-pyridinyl]methanol
CID 79156313
2-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxymethyl]benzonitrile
CID 79158871
[3-[(2-bromo-4-nitrophenyl)methoxy]-6-methyl-2-pyridinyl]methanol
CID 79158522
(1S)-1-[5-chloro-2-[(2,4-dichlorophenyl)methoxy]phenyl]ethanol
CID 78944605
[3-[(4-chloro-1,3-dimethylpyrazol-5-yl)methoxy]-6-methyl-2-pyridinyl]methanol
CID 79156679
2-chloro-6-[(2,4-dichlorophenyl)methoxy]pyridine
CID 121012693
[2-[(2,4-dichlorophenyl)methoxy]-5-methylphenyl]methanamine
CID 63322638
3-[(2,4-dichlorophenyl)methoxy]-4-methoxybenzenecarbothioamide
CID 20991411
[3-[(3-bromophenyl)methoxy]-6-methyl-2-pyridinyl]methanol
CID 79158554
[3-(3-methoxypropoxy)-6-methyl-2-pyridinyl]methanol
CID 79157840

Frequently Asked Questions

What is the IUPAC name of [3-[(2,4-dichlorophenyl)methoxy]-6-methyl-2-pyridinyl]methanol?
The IUPAC name of [3-[(2,4-dichlorophenyl)methoxy]-6-methyl-2-pyridinyl]methanol (CID 79157833) is [3-[(2,4-dichlorophenyl)methoxy]-6-methyl-2-pyridinyl]methanol.
What is the SMILES notation for [3-[(2,4-dichlorophenyl)methoxy]-6-methyl-2-pyridinyl]methanol?
The canonical SMILES for [3-[(2,4-dichlorophenyl)methoxy]-6-methyl-2-pyridinyl]methanol is Cc1ccc(OCc2ccc(Cl)cc2Cl)c(CO)n1.
What is the InChIKey of [3-[(2,4-dichlorophenyl)methoxy]-6-methyl-2-pyridinyl]methanol?
The InChIKey is RKNHEGAYFAXUJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2NO2/c1-9-2-5-14(13(7-18)17-9)19-8-10-3-4-11(15)6-12(10)16/h2-6,18H,7-8H2,1H3.
What are the key properties of [3-[(2,4-dichlorophenyl)methoxy]-6-methyl-2-pyridinyl]methanol?
[3-[(2,4-dichlorophenyl)methoxy]-6-methyl-2-pyridinyl]methanol has a molecular weight of 298.17 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(2,4-dichlorophenyl)methoxy]-6-methyl-2-pyridinyl]methanol is sourced from PubChem (CID 79157833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).