[2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)oxy]phenyl]methanol

C15H18N2O3 — CID 63653601

IUPAC[2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)oxy]phenyl]methanol
SMILESCC(C)Oc1nc(Oc2ccccc2CO)ccc1N
InChIInChI=1S/C15H18N2O3/c1-10(2)19-15-12(16)7-8-14(17-15)20-13-6-4-3-5-11(13)9-18/h3-8,10,18H,9,16H2,1-2H3
InChIKeyQLHPKNRCUDUUNX-UHFFFAOYSA-N
MW274.32 g/mol
LogP2.74
Rot. Bonds5

About [2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)oxy]phenyl]methanol

[2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)oxy]phenyl]methanol (PubChem CID 63653601) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is [2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)oxy]phenyl]methanol.

Molecular Properties

Compound Name[2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)oxy]phenyl]methanol
PubChem CID63653601
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC Name[2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)oxy]phenyl]methanol
SMILESCC(C)Oc1nc(Oc2ccccc2CO)ccc1N
InChIInChI=1S/C15H18N2O3/c1-10(2)19-15-12(16)7-8-14(17-15)20-13-6-4-3-5-11(13)9-18/h3-8,10,18H,9,16H2,1-2H3
InChIKeyQLHPKNRCUDUUNX-UHFFFAOYSA-N
XLogP2.74
TPSA77.60 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)oxy]phenyl]methanol?
The IUPAC name of [2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)oxy]phenyl]methanol (CID 63653601) is [2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)oxy]phenyl]methanol.
What is the SMILES notation for [2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)oxy]phenyl]methanol?
The canonical SMILES for [2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)oxy]phenyl]methanol is CC(C)Oc1nc(Oc2ccccc2CO)ccc1N.
What is the InChIKey of [2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)oxy]phenyl]methanol?
The InChIKey is QLHPKNRCUDUUNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-10(2)19-15-12(16)7-8-14(17-15)20-13-6-4-3-5-11(13)9-18/h3-8,10,18H,9,16H2,1-2H3.
What are the key properties of [2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)oxy]phenyl]methanol?
[2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)oxy]phenyl]methanol has a molecular weight of 274.32 g/mol, XLogP of 2.74, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)oxy]phenyl]methanol is sourced from PubChem (CID 63653601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).