(2,4-dihydroxy-5-propan-2-ylphenyl)-morpholin-4-ylmethanone

C14H19NO4 — CID 11849169

IUPAC(2,4-dihydroxy-5-propan-2-ylphenyl)-morpholin-4-ylmethanone
SMILESCC(C)c1cc(C(=O)N2CCOCC2)c(O)cc1O
InChIInChI=1S/C14H19NO4/c1-9(2)10-7-11(13(17)8-12(10)16)14(18)15-3-5-19-6-4-15/h7-9,16-17H,3-6H2,1-2H3
InChIKeyUZDJCKLFWUFKAA-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.69
Rot. Bonds2

About (2,4-dihydroxy-5-propan-2-ylphenyl)-morpholin-4-ylmethanone

(2,4-dihydroxy-5-propan-2-ylphenyl)-morpholin-4-ylmethanone (PubChem CID 11849169) has the molecular formula C14H19NO4 and a molecular weight of 265.31 g/mol. Its IUPAC name is (2,4-dihydroxy-5-propan-2-ylphenyl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(2,4-dihydroxy-5-propan-2-ylphenyl)-morpholin-4-ylmethanone
PubChem CID11849169
Molecular FormulaC14H19NO4
Molecular Weight265.31 g/mol
Exact Mass265.13
IUPAC Name(2,4-dihydroxy-5-propan-2-ylphenyl)-morpholin-4-ylmethanone
SMILESCC(C)c1cc(C(=O)N2CCOCC2)c(O)cc1O
InChIInChI=1S/C14H19NO4/c1-9(2)10-7-11(13(17)8-12(10)16)14(18)15-3-5-19-6-4-15/h7-9,16-17H,3-6H2,1-2H3
InChIKeyUZDJCKLFWUFKAA-UHFFFAOYSA-N
XLogP1.69
TPSA70.00 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2,4-dihydroxy-5-propan-2-ylphenyl)-morpholin-4-ylmethanone?
The IUPAC name of (2,4-dihydroxy-5-propan-2-ylphenyl)-morpholin-4-ylmethanone (CID 11849169) is (2,4-dihydroxy-5-propan-2-ylphenyl)-morpholin-4-ylmethanone.
What is the SMILES notation for (2,4-dihydroxy-5-propan-2-ylphenyl)-morpholin-4-ylmethanone?
The canonical SMILES for (2,4-dihydroxy-5-propan-2-ylphenyl)-morpholin-4-ylmethanone is CC(C)c1cc(C(=O)N2CCOCC2)c(O)cc1O.
What is the InChIKey of (2,4-dihydroxy-5-propan-2-ylphenyl)-morpholin-4-ylmethanone?
The InChIKey is UZDJCKLFWUFKAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO4/c1-9(2)10-7-11(13(17)8-12(10)16)14(18)15-3-5-19-6-4-15/h7-9,16-17H,3-6H2,1-2H3.
What are the key properties of (2,4-dihydroxy-5-propan-2-ylphenyl)-morpholin-4-ylmethanone?
(2,4-dihydroxy-5-propan-2-ylphenyl)-morpholin-4-ylmethanone has a molecular weight of 265.31 g/mol, XLogP of 1.69, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dihydroxy-5-propan-2-ylphenyl)-morpholin-4-ylmethanone is sourced from PubChem (CID 11849169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).