(5-ethyl-2-methylmorpholin-4-yl)-(2-hydroxy-4-methoxyphenyl)methanone

C15H21NO4 — CID 60717314

IUPAC(5-ethyl-2-methylmorpholin-4-yl)-(2-hydroxy-4-methoxyphenyl)methanone
SMILESCCC1COC(C)CN1C(=O)c1ccc(OC)cc1O
InChIInChI=1S/C15H21NO4/c1-4-11-9-20-10(2)8-16(11)15(18)13-6-5-12(19-3)7-14(13)17/h5-7,10-11,17H,4,8-9H2,1-3H3
InChIKeySAZMBLMBUJUGKB-UHFFFAOYSA-N
MW279.34 g/mol
LogP2.04
Rot. Bonds3

About (5-ethyl-2-methylmorpholin-4-yl)-(2-hydroxy-4-methoxyphenyl)methanone

(5-ethyl-2-methylmorpholin-4-yl)-(2-hydroxy-4-methoxyphenyl)methanone (PubChem CID 60717314) has the molecular formula C15H21NO4 and a molecular weight of 279.34 g/mol. Its IUPAC name is (5-ethyl-2-methylmorpholin-4-yl)-(2-hydroxy-4-methoxyphenyl)methanone.

Molecular Properties

Compound Name(5-ethyl-2-methylmorpholin-4-yl)-(2-hydroxy-4-methoxyphenyl)methanone
PubChem CID60717314
Molecular FormulaC15H21NO4
Molecular Weight279.34 g/mol
Exact Mass279.15
IUPAC Name(5-ethyl-2-methylmorpholin-4-yl)-(2-hydroxy-4-methoxyphenyl)methanone
SMILESCCC1COC(C)CN1C(=O)c1ccc(OC)cc1O
InChIInChI=1S/C15H21NO4/c1-4-11-9-20-10(2)8-16(11)15(18)13-6-5-12(19-3)7-14(13)17/h5-7,10-11,17H,4,8-9H2,1-3H3
InChIKeySAZMBLMBUJUGKB-UHFFFAOYSA-N
XLogP2.04
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (5-ethyl-2-methylmorpholin-4-yl)-(2-hydroxy-4-methoxyphenyl)methanone?
The IUPAC name of (5-ethyl-2-methylmorpholin-4-yl)-(2-hydroxy-4-methoxyphenyl)methanone (CID 60717314) is (5-ethyl-2-methylmorpholin-4-yl)-(2-hydroxy-4-methoxyphenyl)methanone.
What is the SMILES notation for (5-ethyl-2-methylmorpholin-4-yl)-(2-hydroxy-4-methoxyphenyl)methanone?
The canonical SMILES for (5-ethyl-2-methylmorpholin-4-yl)-(2-hydroxy-4-methoxyphenyl)methanone is CCC1COC(C)CN1C(=O)c1ccc(OC)cc1O.
What is the InChIKey of (5-ethyl-2-methylmorpholin-4-yl)-(2-hydroxy-4-methoxyphenyl)methanone?
The InChIKey is SAZMBLMBUJUGKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO4/c1-4-11-9-20-10(2)8-16(11)15(18)13-6-5-12(19-3)7-14(13)17/h5-7,10-11,17H,4,8-9H2,1-3H3.
What are the key properties of (5-ethyl-2-methylmorpholin-4-yl)-(2-hydroxy-4-methoxyphenyl)methanone?
(5-ethyl-2-methylmorpholin-4-yl)-(2-hydroxy-4-methoxyphenyl)methanone has a molecular weight of 279.34 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-ethyl-2-methylmorpholin-4-yl)-(2-hydroxy-4-methoxyphenyl)methanone is sourced from PubChem (CID 60717314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).