2-tert-butyl-6-(morpholin-4-ylmethyl)pyridin-3-ol;hydrochloride

C14H23ClN2O2 — CID 6602670

IUPAC2-tert-butyl-6-(morpholin-4-ylmethyl)pyridin-3-ol;hydrochloride
SMILESCC(C)(C)c1nc(CN2CCOCC2)ccc1O.Cl
InChIInChI=1S/C14H22N2O2.ClH/c1-14(2,3)13-12(17)5-4-11(15-13)10-16-6-8-18-9-7-16;/h4-5,17H,6-10H2,1-3H3;1H
InChIKeyGHIOGVLQIPWWRU-UHFFFAOYSA-N
MW286.80 g/mol
LogP2.34
Rot. Bonds2

About 2-tert-butyl-6-(morpholin-4-ylmethyl)pyridin-3-ol;hydrochloride

2-tert-butyl-6-(morpholin-4-ylmethyl)pyridin-3-ol;hydrochloride (PubChem CID 6602670) has the molecular formula C14H23ClN2O2 and a molecular weight of 286.80 g/mol. Its IUPAC name is 2-tert-butyl-6-(morpholin-4-ylmethyl)pyridin-3-ol;hydrochloride.

Molecular Properties

Compound Name2-tert-butyl-6-(morpholin-4-ylmethyl)pyridin-3-ol;hydrochloride
PubChem CID6602670
Molecular FormulaC14H23ClN2O2
Molecular Weight286.80 g/mol
Exact Mass286.14
IUPAC Name2-tert-butyl-6-(morpholin-4-ylmethyl)pyridin-3-ol;hydrochloride
SMILESCC(C)(C)c1nc(CN2CCOCC2)ccc1O.Cl
InChIInChI=1S/C14H22N2O2.ClH/c1-14(2,3)13-12(17)5-4-11(15-13)10-16-6-8-18-9-7-16;/h4-5,17H,6-10H2,1-3H3;1H
InChIKeyGHIOGVLQIPWWRU-UHFFFAOYSA-N
XLogP2.34
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.80
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-6-(morpholin-4-ylmethyl)pyridin-3-ol;hydrochloride?
The IUPAC name of 2-tert-butyl-6-(morpholin-4-ylmethyl)pyridin-3-ol;hydrochloride (CID 6602670) is 2-tert-butyl-6-(morpholin-4-ylmethyl)pyridin-3-ol;hydrochloride.
What is the SMILES notation for 2-tert-butyl-6-(morpholin-4-ylmethyl)pyridin-3-ol;hydrochloride?
The canonical SMILES for 2-tert-butyl-6-(morpholin-4-ylmethyl)pyridin-3-ol;hydrochloride is CC(C)(C)c1nc(CN2CCOCC2)ccc1O.Cl.
What is the InChIKey of 2-tert-butyl-6-(morpholin-4-ylmethyl)pyridin-3-ol;hydrochloride?
The InChIKey is GHIOGVLQIPWWRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2.ClH/c1-14(2,3)13-12(17)5-4-11(15-13)10-16-6-8-18-9-7-16;/h4-5,17H,6-10H2,1-3H3;1H.
What are the key properties of 2-tert-butyl-6-(morpholin-4-ylmethyl)pyridin-3-ol;hydrochloride?
2-tert-butyl-6-(morpholin-4-ylmethyl)pyridin-3-ol;hydrochloride has a molecular weight of 286.80 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-6-(morpholin-4-ylmethyl)pyridin-3-ol;hydrochloride is sourced from PubChem (CID 6602670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).