2-[[5-[(2,4-dimethylphenyl)methylamino]-2-pyridinyl]oxy]ethanol

C16H20N2O2 — CID 109379933

IUPAC2-[[5-[(2,4-dimethylphenyl)methylamino]-2-pyridinyl]oxy]ethanol
SMILESCc1ccc(CNc2ccc(OCCO)nc2)c(C)c1
InChIInChI=1S/C16H20N2O2/c1-12-3-4-14(13(2)9-12)10-17-15-5-6-16(18-11-15)20-8-7-19/h3-6,9,11,17,19H,7-8,10H2,1-2H3
InChIKeyDNZUDIPMCQLEJB-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.68
Rot. Bonds6

About 2-[[5-[(2,4-dimethylphenyl)methylamino]-2-pyridinyl]oxy]ethanol

2-[[5-[(2,4-dimethylphenyl)methylamino]-2-pyridinyl]oxy]ethanol (PubChem CID 109379933) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-[[5-[(2,4-dimethylphenyl)methylamino]-2-pyridinyl]oxy]ethanol.

Molecular Properties

Compound Name2-[[5-[(2,4-dimethylphenyl)methylamino]-2-pyridinyl]oxy]ethanol
PubChem CID109379933
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name2-[[5-[(2,4-dimethylphenyl)methylamino]-2-pyridinyl]oxy]ethanol
SMILESCc1ccc(CNc2ccc(OCCO)nc2)c(C)c1
InChIInChI=1S/C16H20N2O2/c1-12-3-4-14(13(2)9-12)10-17-15-5-6-16(18-11-15)20-8-7-19/h3-6,9,11,17,19H,7-8,10H2,1-2H3
InChIKeyDNZUDIPMCQLEJB-UHFFFAOYSA-N
XLogP2.68
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[5-[(3-methoxy-4-methylphenyl)methylamino]-2-pyridinyl]oxy]ethanol
CID 99841271
N-[(2,4-dimethylphenyl)methyl]-4-propoxyaniline
CID 63476952
2-[[5-[[4-(dimethylamino)phenyl]methylamino]-2-pyridinyl]oxy]ethanol
CID 109379984
4-[[(6-ethoxy-3-pyridinyl)amino]methyl]-3-methylbenzonitrile
CID 114480567
2-[[5-(furan-2-ylmethylamino)-2-pyridinyl]oxy]ethanol
CID 109379880
N-[(2,4-dimethylphenyl)methyl]-6-pyrrolidin-1-ylpyridin-3-amine
CID 43689488
2-[[5-[(6-chloroquinolin-8-yl)methylamino]-2-pyridinyl]oxy]ethanol
CID 109379970
2-[[5-[(3-fluoro-4-methoxyphenyl)methylamino]-2-pyridinyl]oxy]ethanol
CID 109379922
4-[[[6-(2-methoxyethoxy)-3-pyridinyl]amino]methyl]benzene-1,3-diol
CID 43688370
4-[[[6-(2-hydroxyethoxy)-3-pyridinyl]amino]methyl]benzonitrile
CID 109379854
2-[[5-[(3-chlorothiophen-2-yl)methylamino]-2-pyridinyl]oxy]ethanol
CID 99837201
2-[[5-(3,6-dihydro-2H-pyran-5-ylmethylamino)-2-pyridinyl]oxy]ethanol
CID 109379967

Frequently Asked Questions

What is the IUPAC name of 2-[[5-[(2,4-dimethylphenyl)methylamino]-2-pyridinyl]oxy]ethanol?
The IUPAC name of 2-[[5-[(2,4-dimethylphenyl)methylamino]-2-pyridinyl]oxy]ethanol (CID 109379933) is 2-[[5-[(2,4-dimethylphenyl)methylamino]-2-pyridinyl]oxy]ethanol.
What is the SMILES notation for 2-[[5-[(2,4-dimethylphenyl)methylamino]-2-pyridinyl]oxy]ethanol?
The canonical SMILES for 2-[[5-[(2,4-dimethylphenyl)methylamino]-2-pyridinyl]oxy]ethanol is Cc1ccc(CNc2ccc(OCCO)nc2)c(C)c1.
What is the InChIKey of 2-[[5-[(2,4-dimethylphenyl)methylamino]-2-pyridinyl]oxy]ethanol?
The InChIKey is DNZUDIPMCQLEJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-12-3-4-14(13(2)9-12)10-17-15-5-6-16(18-11-15)20-8-7-19/h3-6,9,11,17,19H,7-8,10H2,1-2H3.
What are the key properties of 2-[[5-[(2,4-dimethylphenyl)methylamino]-2-pyridinyl]oxy]ethanol?
2-[[5-[(2,4-dimethylphenyl)methylamino]-2-pyridinyl]oxy]ethanol has a molecular weight of 272.35 g/mol, XLogP of 2.68, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-[(2,4-dimethylphenyl)methylamino]-2-pyridinyl]oxy]ethanol is sourced from PubChem (CID 109379933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).