4-[(R)-methylsulfinyl]-N-(2-morpholin-4-ylphenyl)benzamide

C18H20N2O3S — CID 95332749

IUPAC4-[(R)-methylsulfinyl]-N-(2-morpholin-4-ylphenyl)benzamide
SMILESC[S@@](=O)c1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1
InChIInChI=1S/C18H20N2O3S/c1-24(22)15-8-6-14(7-9-15)18(21)19-16-4-2-3-5-17(16)20-10-12-23-13-11-20/h2-9H,10-13H2,1H3,(H,19,21)/t24-/m1/s1
InChIKeyPSDJVSBPXFGAMS-XMMPIXPASA-N
MW344.44 g/mol
LogP2.51
Rot. Bonds4

About 4-[(R)-methylsulfinyl]-N-(2-morpholin-4-ylphenyl)benzamide

4-[(R)-methylsulfinyl]-N-(2-morpholin-4-ylphenyl)benzamide (PubChem CID 95332749) has the molecular formula C18H20N2O3S and a molecular weight of 344.44 g/mol. Its IUPAC name is 4-[(R)-methylsulfinyl]-N-(2-morpholin-4-ylphenyl)benzamide.

Molecular Properties

Compound Name4-[(R)-methylsulfinyl]-N-(2-morpholin-4-ylphenyl)benzamide
PubChem CID95332749
Molecular FormulaC18H20N2O3S
Molecular Weight344.44 g/mol
Exact Mass344.12
IUPAC Name4-[(R)-methylsulfinyl]-N-(2-morpholin-4-ylphenyl)benzamide
SMILESC[S@@](=O)c1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1
InChIInChI=1S/C18H20N2O3S/c1-24(22)15-8-6-14(7-9-15)18(21)19-16-4-2-3-5-17(16)20-10-12-23-13-11-20/h2-9H,10-13H2,1H3,(H,19,21)/t24-/m1/s1
InChIKeyPSDJVSBPXFGAMS-XMMPIXPASA-N
XLogP2.51
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.44
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethyl-N-(2-morpholin-4-ylphenyl)benzamide
CID 2677776
4-(2-methylpropyl)-N-(2-morpholin-4-ylphenyl)benzamide
CID 17438048
3,5-dimethyl-N-(2-morpholin-4-ylphenyl)benzamide
CID 969408
3-chloro-4-methyl-N-(2-morpholin-4-ylphenyl)benzamide
CID 898180
3-amino-4-methyl-N-(2-morpholin-4-ylphenyl)benzamide
CID 28723668
6-methyl-N-(2-morpholin-4-ylphenyl)pyridine-3-carboxamide
CID 18148178
N-(2-morpholin-4-ylphenyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 2996589
N-(2-morpholin-4-ylphenyl)-1,2-oxazole-4-carboxamide
CID 110862325
4-iodo-N-[(2-morpholin-4-ylphenyl)carbamothioyl]benzamide
CID 1017014
1-acetyl-N-(2-morpholin-4-ylphenyl)-2,3-dihydroindole-5-carboxamide
CID 51265668
4-(cyclopropylsulfamoyl)-N-(2-morpholin-4-ylphenyl)benzamide
CID 55377324
2-methyl-N-(2-morpholin-4-ylphenyl)-1H-indole-5-carboxamide
CID 110695108

Frequently Asked Questions

What is the IUPAC name of 4-[(R)-methylsulfinyl]-N-(2-morpholin-4-ylphenyl)benzamide?
The IUPAC name of 4-[(R)-methylsulfinyl]-N-(2-morpholin-4-ylphenyl)benzamide (CID 95332749) is 4-[(R)-methylsulfinyl]-N-(2-morpholin-4-ylphenyl)benzamide.
What is the SMILES notation for 4-[(R)-methylsulfinyl]-N-(2-morpholin-4-ylphenyl)benzamide?
The canonical SMILES for 4-[(R)-methylsulfinyl]-N-(2-morpholin-4-ylphenyl)benzamide is C[S@@](=O)c1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1.
What is the InChIKey of 4-[(R)-methylsulfinyl]-N-(2-morpholin-4-ylphenyl)benzamide?
The InChIKey is PSDJVSBPXFGAMS-XMMPIXPASA-N. The full InChI is InChI=1S/C18H20N2O3S/c1-24(22)15-8-6-14(7-9-15)18(21)19-16-4-2-3-5-17(16)20-10-12-23-13-11-20/h2-9H,10-13H2,1H3,(H,19,21)/t24-/m1/s1.
What are the key properties of 4-[(R)-methylsulfinyl]-N-(2-morpholin-4-ylphenyl)benzamide?
4-[(R)-methylsulfinyl]-N-(2-morpholin-4-ylphenyl)benzamide has a molecular weight of 344.44 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(R)-methylsulfinyl]-N-(2-morpholin-4-ylphenyl)benzamide is sourced from PubChem (CID 95332749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).