1-[(5-chloro-3-pyridinyl)oxy]-3-(ethylamino)-2-methylpropan-2-ol

C11H17ClN2O2 — CID 66335510

IUPAC1-[(5-chloro-3-pyridinyl)oxy]-3-(ethylamino)-2-methylpropan-2-ol
SMILESCCNCC(C)(O)COc1cncc(Cl)c1
InChIInChI=1S/C11H17ClN2O2/c1-3-13-7-11(2,15)8-16-10-4-9(12)5-14-6-10/h4-6,13,15H,3,7-8H2,1-2H3
InChIKeyAHPPJLIZFFQFSO-UHFFFAOYSA-N
MW244.72 g/mol
LogP1.47
Rot. Bonds6

About 1-[(5-chloro-3-pyridinyl)oxy]-3-(ethylamino)-2-methylpropan-2-ol

1-[(5-chloro-3-pyridinyl)oxy]-3-(ethylamino)-2-methylpropan-2-ol (PubChem CID 66335510) has the molecular formula C11H17ClN2O2 and a molecular weight of 244.72 g/mol. Its IUPAC name is 1-[(5-chloro-3-pyridinyl)oxy]-3-(ethylamino)-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-[(5-chloro-3-pyridinyl)oxy]-3-(ethylamino)-2-methylpropan-2-ol
PubChem CID66335510
Molecular FormulaC11H17ClN2O2
Molecular Weight244.72 g/mol
Exact Mass244.10
IUPAC Name1-[(5-chloro-3-pyridinyl)oxy]-3-(ethylamino)-2-methylpropan-2-ol
SMILESCCNCC(C)(O)COc1cncc(Cl)c1
InChIInChI=1S/C11H17ClN2O2/c1-3-13-7-11(2,15)8-16-10-4-9(12)5-14-6-10/h4-6,13,15H,3,7-8H2,1-2H3
InChIKeyAHPPJLIZFFQFSO-UHFFFAOYSA-N
XLogP1.47
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.72
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-chloro-3,5-dimethylphenoxy)-3-(ethylamino)-2-methylpropan-2-ol
CID 66336408
1-(4-chloro-2-fluorophenoxy)-3-(ethylamino)-2-methylpropan-2-ol
CID 114267868
1-(ethylamino)-3-(4-iodophenoxy)-2-methylpropan-2-ol
CID 66335040
1-(ethylamino)-2-methyl-3-(3-methyl-4-propan-2-ylphenoxy)propan-2-ol
CID 66335781
1-(ethylamino)-2-methyl-3-(4-phenylphenoxy)propan-2-ol
CID 66336102
N-[[5-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]ethanamine
CID 64601411
3-[2-(bromomethyl)-2-propylpentoxy]-5-chloropyridine
CID 65005847
1-(2,6-dimethylphenoxy)-3-(ethylamino)-2-methylpropan-2-ol
CID 66335778
1-(2,4-dimethylphenoxy)-3-(ethylamino)-2-methylpropan-2-ol
CID 66336681
tert-butyl 3-[(5-chloro-3-pyridinyl)oxy]propanoate
CID 116659230
3-chloro-5-(2-chloroethoxy)pyridine
CID 10559633
1-(5-bromo-2-methylphenoxy)-3-(ethylamino)-2-methylpropan-2-ol
CID 107283637

Frequently Asked Questions

What is the IUPAC name of 1-[(5-chloro-3-pyridinyl)oxy]-3-(ethylamino)-2-methylpropan-2-ol?
The IUPAC name of 1-[(5-chloro-3-pyridinyl)oxy]-3-(ethylamino)-2-methylpropan-2-ol (CID 66335510) is 1-[(5-chloro-3-pyridinyl)oxy]-3-(ethylamino)-2-methylpropan-2-ol.
What is the SMILES notation for 1-[(5-chloro-3-pyridinyl)oxy]-3-(ethylamino)-2-methylpropan-2-ol?
The canonical SMILES for 1-[(5-chloro-3-pyridinyl)oxy]-3-(ethylamino)-2-methylpropan-2-ol is CCNCC(C)(O)COc1cncc(Cl)c1.
What is the InChIKey of 1-[(5-chloro-3-pyridinyl)oxy]-3-(ethylamino)-2-methylpropan-2-ol?
The InChIKey is AHPPJLIZFFQFSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClN2O2/c1-3-13-7-11(2,15)8-16-10-4-9(12)5-14-6-10/h4-6,13,15H,3,7-8H2,1-2H3.
What are the key properties of 1-[(5-chloro-3-pyridinyl)oxy]-3-(ethylamino)-2-methylpropan-2-ol?
1-[(5-chloro-3-pyridinyl)oxy]-3-(ethylamino)-2-methylpropan-2-ol has a molecular weight of 244.72 g/mol, XLogP of 1.47, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-chloro-3-pyridinyl)oxy]-3-(ethylamino)-2-methylpropan-2-ol is sourced from PubChem (CID 66335510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).