(3,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone

C20H23NO5 — CID 110327180

IUPAC(3,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone
SMILESCOc1ccc(C2CN(C(=O)c3cc(OC)cc(OC)c3)CCO2)cc1
InChIInChI=1S/C20H23NO5/c1-23-16-6-4-14(5-7-16)19-13-21(8-9-26-19)20(22)15-10-17(24-2)12-18(11-15)25-3/h4-7,10-12,19H,8-9,13H2,1-3H3
InChIKeyYVXRHBMDSQNZFU-UHFFFAOYSA-N
MW357.41 g/mol
LogP2.93
Rot. Bonds5

About (3,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone

(3,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone (PubChem CID 110327180) has the molecular formula C20H23NO5 and a molecular weight of 357.41 g/mol. Its IUPAC name is (3,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone.

Molecular Properties

Compound Name(3,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone
PubChem CID110327180
Molecular FormulaC20H23NO5
Molecular Weight357.41 g/mol
Exact Mass357.16
IUPAC Name(3,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone
SMILESCOc1ccc(C2CN(C(=O)c3cc(OC)cc(OC)c3)CCO2)cc1
InChIInChI=1S/C20H23NO5/c1-23-16-6-4-14(5-7-16)19-13-21(8-9-26-19)20(22)15-10-17(24-2)12-18(11-15)25-3/h4-7,10-12,19H,8-9,13H2,1-3H3
InChIKeyYVXRHBMDSQNZFU-UHFFFAOYSA-N
XLogP2.93
TPSA57.23 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1,3-benzodioxol-5-yl-[2-(4-methoxyphenyl)morpholin-4-yl]methanone
CID 110327211
(3,5-dimethoxyphenyl)-[(2R)-2-methylmorpholin-4-yl]methanone
CID 51710349
1-[2-(4-methoxyphenyl)morpholin-4-yl]-2-methylpropan-1-one
CID 110327157
(4-hydroxy-3-methoxyphenyl)-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone
CID 95550019
(2-fluorophenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone
CID 110327171
(2-amino-4-pyridinyl)-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone
CID 95555521
4-(3,5-dimethoxybenzoyl)morpholine-2-carbonitrile
CID 78945956
(3,5-dimethoxyphenyl)-[2-(hydroxymethyl)morpholin-4-yl]methanone
CID 81208576
[2-(3,5-dichlorophenyl)morpholin-4-yl]-(3-methoxyphenyl)methanone
CID 121134461
[3-(hydroxymethyl)phenyl]-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone
CID 95468929
[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]-[2-(methylamino)-4-pyridinyl]methanone
CID 56874345
(2,5-dimethoxyphenyl)-(2-phenylmorpholin-4-yl)methanone
CID 84544929

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone?
The IUPAC name of (3,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone (CID 110327180) is (3,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone.
What is the SMILES notation for (3,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone?
The canonical SMILES for (3,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone is COc1ccc(C2CN(C(=O)c3cc(OC)cc(OC)c3)CCO2)cc1.
What is the InChIKey of (3,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone?
The InChIKey is YVXRHBMDSQNZFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO5/c1-23-16-6-4-14(5-7-16)19-13-21(8-9-26-19)20(22)15-10-17(24-2)12-18(11-15)25-3/h4-7,10-12,19H,8-9,13H2,1-3H3.
What are the key properties of (3,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone?
(3,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone has a molecular weight of 357.41 g/mol, XLogP of 2.93, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone is sourced from PubChem (CID 110327180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).