2-morpholin-3-yl-1-(4-propan-2-yloxyphenyl)ethanamine

C15H24N2O2 — CID 116941496

IUPAC2-morpholin-3-yl-1-(4-propan-2-yloxyphenyl)ethanamine
SMILESCC(C)Oc1ccc(C(N)CC2COCCN2)cc1
InChIInChI=1S/C15H24N2O2/c1-11(2)19-14-5-3-12(4-6-14)15(16)9-13-10-18-8-7-17-13/h3-6,11,13,15,17H,7-10,16H2,1-2H3
InChIKeyXCDAERGLSBJGLR-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.85
Rot. Bonds5

About 2-morpholin-3-yl-1-(4-propan-2-yloxyphenyl)ethanamine

2-morpholin-3-yl-1-(4-propan-2-yloxyphenyl)ethanamine (PubChem CID 116941496) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-morpholin-3-yl-1-(4-propan-2-yloxyphenyl)ethanamine.

Molecular Properties

Compound Name2-morpholin-3-yl-1-(4-propan-2-yloxyphenyl)ethanamine
PubChem CID116941496
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-morpholin-3-yl-1-(4-propan-2-yloxyphenyl)ethanamine
SMILESCC(C)Oc1ccc(C(N)CC2COCCN2)cc1
InChIInChI=1S/C15H24N2O2/c1-11(2)19-14-5-3-12(4-6-14)15(16)9-13-10-18-8-7-17-13/h3-6,11,13,15,17H,7-10,16H2,1-2H3
InChIKeyXCDAERGLSBJGLR-UHFFFAOYSA-N
XLogP1.85
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-3-yl-1-(4-propan-2-yloxyphenyl)ethanamine?
The IUPAC name of 2-morpholin-3-yl-1-(4-propan-2-yloxyphenyl)ethanamine (CID 116941496) is 2-morpholin-3-yl-1-(4-propan-2-yloxyphenyl)ethanamine.
What is the SMILES notation for 2-morpholin-3-yl-1-(4-propan-2-yloxyphenyl)ethanamine?
The canonical SMILES for 2-morpholin-3-yl-1-(4-propan-2-yloxyphenyl)ethanamine is CC(C)Oc1ccc(C(N)CC2COCCN2)cc1.
What is the InChIKey of 2-morpholin-3-yl-1-(4-propan-2-yloxyphenyl)ethanamine?
The InChIKey is XCDAERGLSBJGLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11(2)19-14-5-3-12(4-6-14)15(16)9-13-10-18-8-7-17-13/h3-6,11,13,15,17H,7-10,16H2,1-2H3.
What are the key properties of 2-morpholin-3-yl-1-(4-propan-2-yloxyphenyl)ethanamine?
2-morpholin-3-yl-1-(4-propan-2-yloxyphenyl)ethanamine has a molecular weight of 264.37 g/mol, XLogP of 1.85, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-3-yl-1-(4-propan-2-yloxyphenyl)ethanamine is sourced from PubChem (CID 116941496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).