[(2R)-2-[(2-methoxy-4-methylphenoxy)methyl]morpholin-4-yl]-(2-methylphenyl)methanone

C21H25NO4 — CID 93336839

IUPAC[(2R)-2-[(2-methoxy-4-methylphenoxy)methyl]morpholin-4-yl]-(2-methylphenyl)methanone
SMILESCOc1cc(C)ccc1OC[C@H]1CN(C(=O)c2ccccc2C)CCO1
InChIInChI=1S/C21H25NO4/c1-15-8-9-19(20(12-15)24-3)26-14-17-13-22(10-11-25-17)21(23)18-7-5-4-6-16(18)2/h4-9,12,17H,10-11,13-14H2,1-3H3/t17-/m1/s1
InChIKeyUSNUSFFCSKPVNY-QGZVFWFLSA-N
MW355.43 g/mol
LogP3.23
Rot. Bonds5

About [(2R)-2-[(2-methoxy-4-methylphenoxy)methyl]morpholin-4-yl]-(2-methylphenyl)methanone

[(2R)-2-[(2-methoxy-4-methylphenoxy)methyl]morpholin-4-yl]-(2-methylphenyl)methanone (PubChem CID 93336839) has the molecular formula C21H25NO4 and a molecular weight of 355.43 g/mol. Its IUPAC name is [(2R)-2-[(2-methoxy-4-methylphenoxy)methyl]morpholin-4-yl]-(2-methylphenyl)methanone.

Molecular Properties

Compound Name[(2R)-2-[(2-methoxy-4-methylphenoxy)methyl]morpholin-4-yl]-(2-methylphenyl)methanone
PubChem CID93336839
Molecular FormulaC21H25NO4
Molecular Weight355.43 g/mol
Exact Mass355.18
IUPAC Name[(2R)-2-[(2-methoxy-4-methylphenoxy)methyl]morpholin-4-yl]-(2-methylphenyl)methanone
SMILESCOc1cc(C)ccc1OC[C@H]1CN(C(=O)c2ccccc2C)CCO1
InChIInChI=1S/C21H25NO4/c1-15-8-9-19(20(12-15)24-3)26-14-17-13-22(10-11-25-17)21(23)18-7-5-4-6-16(18)2/h4-9,12,17H,10-11,13-14H2,1-3H3/t17-/m1/s1
InChIKeyUSNUSFFCSKPVNY-QGZVFWFLSA-N
XLogP3.23
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.43
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze [(2R)-2-[(2-methoxy-4-methylphenoxy)methyl]morpholin-4-yl]-(2-methylphenyl)methanone with MolForge

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Related Compounds

(2-chloro-3-pyridinyl)-[(2S)-2-[(2-methoxyphenoxy)methyl]morpholin-4-yl]methanone
CID 92758229
(3,4-dimethoxyphenyl)-[4-[[(2S)-4-(2-methylbenzoyl)morpholin-2-yl]methyl]-1,4-diazepan-1-yl]methanone
CID 93338476
1-[2-(hydroxymethyl)morpholin-4-yl]-2-(2-methoxy-4-methylphenoxy)ethanone
CID 81197403
methyl 2-[4-(2,4-dimethylbenzoyl)morpholin-2-yl]acetate
CID 79812703
[(2R)-2-[(3-methoxyphenoxy)methyl]morpholin-4-yl]-(4-methylphenyl)methanone
CID 93327745
(6-bromo-2-pyridinyl)-[(2S)-2-[(2-methoxyphenoxy)methyl]morpholin-4-yl]methanone
CID 92759778
(2-aminophenyl)-[2-(methoxymethyl)morpholin-4-yl]methanone
CID 119945594
1-[2-[(2-methoxyphenoxy)methyl]morpholin-4-yl]-2-(2,3,4-trimethoxyphenyl)ethanone
CID 46100107
4-[(2,6-difluorophenyl)methyl]-2-[(2-methoxy-4-methylphenoxy)methyl]morpholine
CID 46041207
N-[[4-(2-methoxybenzoyl)morpholin-2-yl]methyl]-N-(2-methoxyethyl)-4-methylbenzamide
CID 42861605
[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]-(4-methylphenyl)methanone
CID 46041087
methyl 4-(2-methylbenzoyl)morpholine-2-carboxylate
CID 78926743

Frequently Asked Questions

What is the IUPAC name of [(2R)-2-[(2-methoxy-4-methylphenoxy)methyl]morpholin-4-yl]-(2-methylphenyl)methanone?
The IUPAC name of [(2R)-2-[(2-methoxy-4-methylphenoxy)methyl]morpholin-4-yl]-(2-methylphenyl)methanone (CID 93336839) is [(2R)-2-[(2-methoxy-4-methylphenoxy)methyl]morpholin-4-yl]-(2-methylphenyl)methanone.
What is the SMILES notation for [(2R)-2-[(2-methoxy-4-methylphenoxy)methyl]morpholin-4-yl]-(2-methylphenyl)methanone?
The canonical SMILES for [(2R)-2-[(2-methoxy-4-methylphenoxy)methyl]morpholin-4-yl]-(2-methylphenyl)methanone is COc1cc(C)ccc1OC[C@H]1CN(C(=O)c2ccccc2C)CCO1.
What is the InChIKey of [(2R)-2-[(2-methoxy-4-methylphenoxy)methyl]morpholin-4-yl]-(2-methylphenyl)methanone?
The InChIKey is USNUSFFCSKPVNY-QGZVFWFLSA-N. The full InChI is InChI=1S/C21H25NO4/c1-15-8-9-19(20(12-15)24-3)26-14-17-13-22(10-11-25-17)21(23)18-7-5-4-6-16(18)2/h4-9,12,17H,10-11,13-14H2,1-3H3/t17-/m1/s1.
What are the key properties of [(2R)-2-[(2-methoxy-4-methylphenoxy)methyl]morpholin-4-yl]-(2-methylphenyl)methanone?
[(2R)-2-[(2-methoxy-4-methylphenoxy)methyl]morpholin-4-yl]-(2-methylphenyl)methanone has a molecular weight of 355.43 g/mol, XLogP of 3.23, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-2-[(2-methoxy-4-methylphenoxy)methyl]morpholin-4-yl]-(2-methylphenyl)methanone is sourced from PubChem (CID 93336839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).