2-[[5-[(2,6-dichlorophenyl)methoxy]-2-pyridinyl]amino]ethanol

C14H14Cl2N2O2 — CID 10403272

IUPAC2-[[5-[(2,6-dichlorophenyl)methoxy]-2-pyridinyl]amino]ethanol
SMILESOCCNc1ccc(OCc2c(Cl)cccc2Cl)cn1
InChIInChI=1S/C14H14Cl2N2O2/c15-12-2-1-3-13(16)11(12)9-20-10-4-5-14(18-8-10)17-6-7-19/h1-5,8,19H,6-7,9H2,(H,17,18)
InChIKeyOXFQJTPCLMTDEE-UHFFFAOYSA-N
MW313.18 g/mol
LogP3.37
Rot. Bonds6

About 2-[[5-[(2,6-dichlorophenyl)methoxy]-2-pyridinyl]amino]ethanol

2-[[5-[(2,6-dichlorophenyl)methoxy]-2-pyridinyl]amino]ethanol (PubChem CID 10403272) has the molecular formula C14H14Cl2N2O2 and a molecular weight of 313.18 g/mol. Its IUPAC name is 2-[[5-[(2,6-dichlorophenyl)methoxy]-2-pyridinyl]amino]ethanol.

Molecular Properties

Compound Name2-[[5-[(2,6-dichlorophenyl)methoxy]-2-pyridinyl]amino]ethanol
PubChem CID10403272
Molecular FormulaC14H14Cl2N2O2
Molecular Weight313.18 g/mol
Exact Mass312.04
IUPAC Name2-[[5-[(2,6-dichlorophenyl)methoxy]-2-pyridinyl]amino]ethanol
SMILESOCCNc1ccc(OCc2c(Cl)cccc2Cl)cn1
InChIInChI=1S/C14H14Cl2N2O2/c15-12-2-1-3-13(16)11(12)9-20-10-4-5-14(18-8-10)17-6-7-19/h1-5,8,19H,6-7,9H2,(H,17,18)
InChIKeyOXFQJTPCLMTDEE-UHFFFAOYSA-N
XLogP3.37
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.18
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[[5-[(2,6-dichlorophenyl)methoxy]-2-pyridinyl]amino]ethanol?
The IUPAC name of 2-[[5-[(2,6-dichlorophenyl)methoxy]-2-pyridinyl]amino]ethanol (CID 10403272) is 2-[[5-[(2,6-dichlorophenyl)methoxy]-2-pyridinyl]amino]ethanol.
What is the SMILES notation for 2-[[5-[(2,6-dichlorophenyl)methoxy]-2-pyridinyl]amino]ethanol?
The canonical SMILES for 2-[[5-[(2,6-dichlorophenyl)methoxy]-2-pyridinyl]amino]ethanol is OCCNc1ccc(OCc2c(Cl)cccc2Cl)cn1.
What is the InChIKey of 2-[[5-[(2,6-dichlorophenyl)methoxy]-2-pyridinyl]amino]ethanol?
The InChIKey is OXFQJTPCLMTDEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14Cl2N2O2/c15-12-2-1-3-13(16)11(12)9-20-10-4-5-14(18-8-10)17-6-7-19/h1-5,8,19H,6-7,9H2,(H,17,18).
What are the key properties of 2-[[5-[(2,6-dichlorophenyl)methoxy]-2-pyridinyl]amino]ethanol?
2-[[5-[(2,6-dichlorophenyl)methoxy]-2-pyridinyl]amino]ethanol has a molecular weight of 313.18 g/mol, XLogP of 3.37, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-[(2,6-dichlorophenyl)methoxy]-2-pyridinyl]amino]ethanol is sourced from PubChem (CID 10403272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).