2-(tert-butylamino)-1-(6-morpholin-4-yl-2-pyridinyl)ethanol

C15H25N3O2 — CID 170592933

IUPAC2-(tert-butylamino)-1-(6-morpholin-4-yl-2-pyridinyl)ethanol
SMILESCC(C)(C)NCC(O)c1cccc(N2CCOCC2)n1
InChIInChI=1S/C15H25N3O2/c1-15(2,3)16-11-13(19)12-5-4-6-14(17-12)18-7-9-20-10-8-18/h4-6,13,16,19H,7-11H2,1-3H3
InChIKeyJKARODREWDQCHM-UHFFFAOYSA-N
MW279.38 g/mol
LogP1.34
Rot. Bonds4

About 2-(tert-butylamino)-1-(6-morpholin-4-yl-2-pyridinyl)ethanol

2-(tert-butylamino)-1-(6-morpholin-4-yl-2-pyridinyl)ethanol (PubChem CID 170592933) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is 2-(tert-butylamino)-1-(6-morpholin-4-yl-2-pyridinyl)ethanol.

Molecular Properties

Compound Name2-(tert-butylamino)-1-(6-morpholin-4-yl-2-pyridinyl)ethanol
PubChem CID170592933
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name2-(tert-butylamino)-1-(6-morpholin-4-yl-2-pyridinyl)ethanol
SMILESCC(C)(C)NCC(O)c1cccc(N2CCOCC2)n1
InChIInChI=1S/C15H25N3O2/c1-15(2,3)16-11-13(19)12-5-4-6-14(17-12)18-7-9-20-10-8-18/h4-6,13,16,19H,7-11H2,1-3H3
InChIKeyJKARODREWDQCHM-UHFFFAOYSA-N
XLogP1.34
TPSA57.62 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)-1-(6-morpholin-4-yl-2-pyridinyl)ethanol?
The IUPAC name of 2-(tert-butylamino)-1-(6-morpholin-4-yl-2-pyridinyl)ethanol (CID 170592933) is 2-(tert-butylamino)-1-(6-morpholin-4-yl-2-pyridinyl)ethanol.
What is the SMILES notation for 2-(tert-butylamino)-1-(6-morpholin-4-yl-2-pyridinyl)ethanol?
The canonical SMILES for 2-(tert-butylamino)-1-(6-morpholin-4-yl-2-pyridinyl)ethanol is CC(C)(C)NCC(O)c1cccc(N2CCOCC2)n1.
What is the InChIKey of 2-(tert-butylamino)-1-(6-morpholin-4-yl-2-pyridinyl)ethanol?
The InChIKey is JKARODREWDQCHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-15(2,3)16-11-13(19)12-5-4-6-14(17-12)18-7-9-20-10-8-18/h4-6,13,16,19H,7-11H2,1-3H3.
What are the key properties of 2-(tert-butylamino)-1-(6-morpholin-4-yl-2-pyridinyl)ethanol?
2-(tert-butylamino)-1-(6-morpholin-4-yl-2-pyridinyl)ethanol has a molecular weight of 279.38 g/mol, XLogP of 1.34, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylamino)-1-(6-morpholin-4-yl-2-pyridinyl)ethanol is sourced from PubChem (CID 170592933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).