(4-ethoxyphenyl)-morpholin-2-ylmethanone

C13H17NO3 — CID 116561587

IUPAC(4-ethoxyphenyl)-morpholin-2-ylmethanone
SMILESCCOc1ccc(C(=O)C2CNCCO2)cc1
InChIInChI=1S/C13H17NO3/c1-2-16-11-5-3-10(4-6-11)13(15)12-9-14-7-8-17-12/h3-6,12,14H,2,7-9H2,1H3
InChIKeyPRZQRIWJLKFVHS-UHFFFAOYSA-N
MW235.28 g/mol
LogP1.26
Rot. Bonds4

About (4-ethoxyphenyl)-morpholin-2-ylmethanone

(4-ethoxyphenyl)-morpholin-2-ylmethanone (PubChem CID 116561587) has the molecular formula C13H17NO3 and a molecular weight of 235.28 g/mol. Its IUPAC name is (4-ethoxyphenyl)-morpholin-2-ylmethanone.

Molecular Properties

Compound Name(4-ethoxyphenyl)-morpholin-2-ylmethanone
PubChem CID116561587
Molecular FormulaC13H17NO3
Molecular Weight235.28 g/mol
Exact Mass235.12
IUPAC Name(4-ethoxyphenyl)-morpholin-2-ylmethanone
SMILESCCOc1ccc(C(=O)C2CNCCO2)cc1
InChIInChI=1S/C13H17NO3/c1-2-16-11-5-3-10(4-6-11)13(15)12-9-14-7-8-17-12/h3-6,12,14H,2,7-9H2,1H3
InChIKeyPRZQRIWJLKFVHS-UHFFFAOYSA-N
XLogP1.26
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.28
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

morpholin-2-yl-(4-propoxyphenyl)methanone
CID 116561682
(4-methylsulfonylphenyl)-morpholin-2-ylmethanone
CID 116919550
ethyl 4-(morpholin-2-ylmethoxy)benzoate
CID 19983185
1-(4-ethoxyphenyl)-2-[4-[(2S)-morpholin-2-yl]phenyl]ethanone
CID 58315606
N-[[2-(4-ethoxyphenoxy)-4-pyridinyl]methyl]morpholine-2-carboxamide
CID 119847525
4-ethoxy-N-[4-[(2S)-morpholin-2-yl]phenyl]benzamide
CID 67239889
(4-ethoxyphenyl)-(5-methyloxolan-2-yl)methanone
CID 81330105
N-[(4-propoxyphenyl)methyl]morpholine-2-carboxamide
CID 119714378
(4-ethoxyphenyl)-(oxolan-3-yl)methanone
CID 61272590
(3-hydroxyphenyl)-morpholin-2-ylmethanone
CID 84675045
N-[4-(2-amino-2-oxoethoxy)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119709306
4-ethoxy-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119453188

Frequently Asked Questions

What is the IUPAC name of (4-ethoxyphenyl)-morpholin-2-ylmethanone?
The IUPAC name of (4-ethoxyphenyl)-morpholin-2-ylmethanone (CID 116561587) is (4-ethoxyphenyl)-morpholin-2-ylmethanone.
What is the SMILES notation for (4-ethoxyphenyl)-morpholin-2-ylmethanone?
The canonical SMILES for (4-ethoxyphenyl)-morpholin-2-ylmethanone is CCOc1ccc(C(=O)C2CNCCO2)cc1.
What is the InChIKey of (4-ethoxyphenyl)-morpholin-2-ylmethanone?
The InChIKey is PRZQRIWJLKFVHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO3/c1-2-16-11-5-3-10(4-6-11)13(15)12-9-14-7-8-17-12/h3-6,12,14H,2,7-9H2,1H3.
What are the key properties of (4-ethoxyphenyl)-morpholin-2-ylmethanone?
(4-ethoxyphenyl)-morpholin-2-ylmethanone has a molecular weight of 235.28 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethoxyphenyl)-morpholin-2-ylmethanone is sourced from PubChem (CID 116561587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).