(2,4-dimethylphenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone

C20H23NO2 — CID 24724237

IUPAC(2,4-dimethylphenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone
SMILESCc1ccc(C(=O)c2ccc(CN3CCOCC3)cc2)c(C)c1
InChIInChI=1S/C20H23NO2/c1-15-3-8-19(16(2)13-15)20(22)18-6-4-17(5-7-18)14-21-9-11-23-12-10-21/h3-8,13H,9-12,14H2,1-2H3
InChIKeyYWMFIORVIMASLR-UHFFFAOYSA-N
MW309.41 g/mol
LogP3.37
Rot. Bonds4

About (2,4-dimethylphenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone

(2,4-dimethylphenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone (PubChem CID 24724237) has the molecular formula C20H23NO2 and a molecular weight of 309.41 g/mol. Its IUPAC name is (2,4-dimethylphenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone.

Molecular Properties

Compound Name(2,4-dimethylphenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone
PubChem CID24724237
Molecular FormulaC20H23NO2
Molecular Weight309.41 g/mol
Exact Mass309.17
IUPAC Name(2,4-dimethylphenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone
SMILESCc1ccc(C(=O)c2ccc(CN3CCOCC3)cc2)c(C)c1
InChIInChI=1S/C20H23NO2/c1-15-3-8-19(16(2)13-15)20(22)18-6-4-17(5-7-18)14-21-9-11-23-12-10-21/h3-8,13H,9-12,14H2,1-2H3
InChIKeyYWMFIORVIMASLR-UHFFFAOYSA-N
XLogP3.37
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2,5-dichlorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone
CID 24724256
(2-methoxyphenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone
CID 24724219
(4-chlorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone
CID 24724233
(2,4-dimethylphenyl)-[3-(pyrrolidin-1-ylmethyl)phenyl]methanone
CID 24724803
ethyl 4-[4-(morpholin-4-ylmethyl)benzoyl]benzoate
CID 24724227
(2-fluorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone
CID 24724246
(3,4-difluorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone
CID 24724260
1-(2,4-dimethylphenyl)-3-morpholin-4-ylpropan-1-one chloride
CID 45108470
CID 59303659
CID 59303659
methyl 4-(morpholin-4-ylmethyl)benzoate
CID 10466592
N,N-dimethyl-4-(morpholin-4-ylmethyl)benzamide
CID 43918660
4-[4-(morpholin-4-ylmethyl)benzoyl]benzonitrile
CID 24724224

Frequently Asked Questions

What is the IUPAC name of (2,4-dimethylphenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone?
The IUPAC name of (2,4-dimethylphenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone (CID 24724237) is (2,4-dimethylphenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone.
What is the SMILES notation for (2,4-dimethylphenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone?
The canonical SMILES for (2,4-dimethylphenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone is Cc1ccc(C(=O)c2ccc(CN3CCOCC3)cc2)c(C)c1.
What is the InChIKey of (2,4-dimethylphenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone?
The InChIKey is YWMFIORVIMASLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO2/c1-15-3-8-19(16(2)13-15)20(22)18-6-4-17(5-7-18)14-21-9-11-23-12-10-21/h3-8,13H,9-12,14H2,1-2H3.
What are the key properties of (2,4-dimethylphenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone?
(2,4-dimethylphenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone has a molecular weight of 309.41 g/mol, XLogP of 3.37, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dimethylphenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone is sourced from PubChem (CID 24724237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).