3-(dimethylamino)-N-(2,4-dimorpholin-4-ylphenyl)benzamide

C23H30N4O3 — CID 26072175

IUPAC3-(dimethylamino)-N-(2,4-dimorpholin-4-ylphenyl)benzamide
SMILESCN(C)c1cccc(C(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)c1
InChIInChI=1S/C23H30N4O3/c1-25(2)19-5-3-4-18(16-19)23(28)24-21-7-6-20(26-8-12-29-13-9-26)17-22(21)27-10-14-30-15-11-27/h3-7,16-17H,8-15H2,1-2H3,(H,24,28)
InChIKeyVGEODDYPLGKUFH-UHFFFAOYSA-N
MW410.52 g/mol
LogP2.68
Rot. Bonds5

About 3-(dimethylamino)-N-(2,4-dimorpholin-4-ylphenyl)benzamide

3-(dimethylamino)-N-(2,4-dimorpholin-4-ylphenyl)benzamide (PubChem CID 26072175) has the molecular formula C23H30N4O3 and a molecular weight of 410.52 g/mol. Its IUPAC name is 3-(dimethylamino)-N-(2,4-dimorpholin-4-ylphenyl)benzamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-(2,4-dimorpholin-4-ylphenyl)benzamide
PubChem CID26072175
Molecular FormulaC23H30N4O3
Molecular Weight410.52 g/mol
Exact Mass410.23
IUPAC Name3-(dimethylamino)-N-(2,4-dimorpholin-4-ylphenyl)benzamide
SMILESCN(C)c1cccc(C(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)c1
InChIInChI=1S/C23H30N4O3/c1-25(2)19-5-3-4-18(16-19)23(28)24-21-7-6-20(26-8-12-29-13-9-26)17-22(21)27-10-14-30-15-11-27/h3-7,16-17H,8-15H2,1-2H3,(H,24,28)
InChIKeyVGEODDYPLGKUFH-UHFFFAOYSA-N
XLogP2.68
TPSA57.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.52
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2,4-dimorpholin-4-ylphenyl)-3-fluorobenzamide
CID 4824008
3-(dimethylamino)-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]benzamide
CID 2326651
3-(dimethylamino)-N-(2-methyl-4-pyrrolidin-1-ylphenyl)benzamide
CID 42157817
N-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide
CID 24676967
3-[methyl(methylsulfonyl)amino]-N-(4-morpholin-4-ylphenyl)benzamide
CID 100524251
3-methyl-N-(2-morpholin-4-yl-5-pyrrolidin-1-ylphenyl)benzamide
CID 110400455
N-[(2R)-1-(2,4-dimorpholin-4-ylanilino)-1-oxopropan-2-yl]-3-methylbenzamide
CID 41080718
N-(2,4-dimorpholin-4-ylphenyl)-6-methylpyridine-3-carboxamide
CID 18149073
N-[5-[(2,4-dimorpholin-4-ylphenyl)carbamoyl]-2-methylphenyl]furan-2-carboxamide
CID 24653710
3-[methyl(phenyl)sulfamoyl]-N-(2-morpholin-4-ylphenyl)benzamide
CID 3389026
3-fluoro-N-(5-morpholin-4-yl-2-pyrrolidin-1-ylphenyl)benzamide
CID 110400397
N-(4-amino-2-methyl-5-morpholin-4-ylphenyl)-3-methylbenzamide
CID 91676207

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-(2,4-dimorpholin-4-ylphenyl)benzamide?
The IUPAC name of 3-(dimethylamino)-N-(2,4-dimorpholin-4-ylphenyl)benzamide (CID 26072175) is 3-(dimethylamino)-N-(2,4-dimorpholin-4-ylphenyl)benzamide.
What is the SMILES notation for 3-(dimethylamino)-N-(2,4-dimorpholin-4-ylphenyl)benzamide?
The canonical SMILES for 3-(dimethylamino)-N-(2,4-dimorpholin-4-ylphenyl)benzamide is CN(C)c1cccc(C(=O)Nc2ccc(N3CCOCC3)cc2N2CCOCC2)c1.
What is the InChIKey of 3-(dimethylamino)-N-(2,4-dimorpholin-4-ylphenyl)benzamide?
The InChIKey is VGEODDYPLGKUFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N4O3/c1-25(2)19-5-3-4-18(16-19)23(28)24-21-7-6-20(26-8-12-29-13-9-26)17-22(21)27-10-14-30-15-11-27/h3-7,16-17H,8-15H2,1-2H3,(H,24,28).
What are the key properties of 3-(dimethylamino)-N-(2,4-dimorpholin-4-ylphenyl)benzamide?
3-(dimethylamino)-N-(2,4-dimorpholin-4-ylphenyl)benzamide has a molecular weight of 410.52 g/mol, XLogP of 2.68, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-(2,4-dimorpholin-4-ylphenyl)benzamide is sourced from PubChem (CID 26072175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).