[3-[[6-(ethylamino)-3-pyridinyl]methoxy]phenyl]methanol

C15H18N2O2 — CID 62189596

IUPAC[3-[[6-(ethylamino)-3-pyridinyl]methoxy]phenyl]methanol
SMILESCCNc1ccc(COc2cccc(CO)c2)cn1
InChIInChI=1S/C15H18N2O2/c1-2-16-15-7-6-13(9-17-15)11-19-14-5-3-4-12(8-14)10-18/h3-9,18H,2,10-11H2,1H3,(H,16,17)
InChIKeyJYKGEOOECIKEEK-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.58
Rot. Bonds6

About [3-[[6-(ethylamino)-3-pyridinyl]methoxy]phenyl]methanol

[3-[[6-(ethylamino)-3-pyridinyl]methoxy]phenyl]methanol (PubChem CID 62189596) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is [3-[[6-(ethylamino)-3-pyridinyl]methoxy]phenyl]methanol.

Molecular Properties

Compound Name[3-[[6-(ethylamino)-3-pyridinyl]methoxy]phenyl]methanol
PubChem CID62189596
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name[3-[[6-(ethylamino)-3-pyridinyl]methoxy]phenyl]methanol
SMILESCCNc1ccc(COc2cccc(CO)c2)cn1
InChIInChI=1S/C15H18N2O2/c1-2-16-15-7-6-13(9-17-15)11-19-14-5-3-4-12(8-14)10-18/h3-9,18H,2,10-11H2,1H3,(H,16,17)
InChIKeyJYKGEOOECIKEEK-UHFFFAOYSA-N
XLogP2.58
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-[[6-(ethylamino)-3-pyridinyl]methoxy]phenyl]methanol?
The IUPAC name of [3-[[6-(ethylamino)-3-pyridinyl]methoxy]phenyl]methanol (CID 62189596) is [3-[[6-(ethylamino)-3-pyridinyl]methoxy]phenyl]methanol.
What is the SMILES notation for [3-[[6-(ethylamino)-3-pyridinyl]methoxy]phenyl]methanol?
The canonical SMILES for [3-[[6-(ethylamino)-3-pyridinyl]methoxy]phenyl]methanol is CCNc1ccc(COc2cccc(CO)c2)cn1.
What is the InChIKey of [3-[[6-(ethylamino)-3-pyridinyl]methoxy]phenyl]methanol?
The InChIKey is JYKGEOOECIKEEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-2-16-15-7-6-13(9-17-15)11-19-14-5-3-4-12(8-14)10-18/h3-9,18H,2,10-11H2,1H3,(H,16,17).
What are the key properties of [3-[[6-(ethylamino)-3-pyridinyl]methoxy]phenyl]methanol?
[3-[[6-(ethylamino)-3-pyridinyl]methoxy]phenyl]methanol has a molecular weight of 258.32 g/mol, XLogP of 2.58, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[[6-(ethylamino)-3-pyridinyl]methoxy]phenyl]methanol is sourced from PubChem (CID 62189596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).