N-[2-(dimethylamino)-2-phenylethyl]-2-methyl-5-methylsulfanylbenzamide

C19H24N2OS — CID 134018244

IUPACN-[2-(dimethylamino)-2-phenylethyl]-2-methyl-5-methylsulfanylbenzamide
SMILESCSc1ccc(C)c(C(=O)NCC(c2ccccc2)N(C)C)c1
InChIInChI=1S/C19H24N2OS/c1-14-10-11-16(23-4)12-17(14)19(22)20-13-18(21(2)3)15-8-6-5-7-9-15/h5-12,18H,13H2,1-4H3,(H,20,22)
InChIKeyCMVDOSYBCPGSCR-UHFFFAOYSA-N
MW328.48 g/mol
LogP3.75
Rot. Bonds6

About N-[2-(dimethylamino)-2-phenylethyl]-2-methyl-5-methylsulfanylbenzamide

N-[2-(dimethylamino)-2-phenylethyl]-2-methyl-5-methylsulfanylbenzamide (PubChem CID 134018244) has the molecular formula C19H24N2OS and a molecular weight of 328.48 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-phenylethyl]-2-methyl-5-methylsulfanylbenzamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-phenylethyl]-2-methyl-5-methylsulfanylbenzamide
PubChem CID134018244
Molecular FormulaC19H24N2OS
Molecular Weight328.48 g/mol
Exact Mass328.16
IUPAC NameN-[2-(dimethylamino)-2-phenylethyl]-2-methyl-5-methylsulfanylbenzamide
SMILESCSc1ccc(C)c(C(=O)NCC(c2ccccc2)N(C)C)c1
InChIInChI=1S/C19H24N2OS/c1-14-10-11-16(23-4)12-17(14)19(22)20-13-18(21(2)3)15-8-6-5-7-9-15/h5-12,18H,13H2,1-4H3,(H,20,22)
InChIKeyCMVDOSYBCPGSCR-UHFFFAOYSA-N
XLogP3.75
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.48
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(dimethylamino)-2-phenylethyl]-2-methyl-5-methylsulfanylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-2-methyl-5-methylsulfanylbenzamide
CID 43047884
2-methoxy-3-[(2-methyl-5-methylsulfanylbenzoyl)amino]propanoic acid
CID 106107843
N-[2-(2-fluorophenyl)-2-hydroxyethyl]-2-methyl-5-methylsulfanylbenzamide
CID 111565791
N-[(2R)-2-(dimethylamino)-2-phenylethyl]-3,5-difluorobenzamide
CID 7897282
2,4-dichloro-N-[(2R)-2-(dimethylamino)-2-phenylethyl]benzamide
CID 27230027
N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-5-methylsulfanyl-2-nitrobenzamide
CID 51305456
N-(2-acetamidoethyl)-2-methyl-5-methylsulfanylbenzamide
CID 47149231
N-[2-(dimethylamino)-2-phenylethyl]benzamide;hydrochloride
CID 20994991
N-[2-(dimethylamino)-2-phenylethyl]-2-phenylbenzamide
CID 17461099
N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-2-methylbenzamide
CID 46422034
N-(2-hydroxy-2-methylpropyl)-2-methyl-5-methylsulfanylbenzamide
CID 65110031
N-[(2R)-2-(dimethylamino)-2-phenylethyl]-3-methyl-2-nitrobenzamide
CID 27229559

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-phenylethyl]-2-methyl-5-methylsulfanylbenzamide?
The IUPAC name of N-[2-(dimethylamino)-2-phenylethyl]-2-methyl-5-methylsulfanylbenzamide (CID 134018244) is N-[2-(dimethylamino)-2-phenylethyl]-2-methyl-5-methylsulfanylbenzamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-phenylethyl]-2-methyl-5-methylsulfanylbenzamide?
The canonical SMILES for N-[2-(dimethylamino)-2-phenylethyl]-2-methyl-5-methylsulfanylbenzamide is CSc1ccc(C)c(C(=O)NCC(c2ccccc2)N(C)C)c1.
What is the InChIKey of N-[2-(dimethylamino)-2-phenylethyl]-2-methyl-5-methylsulfanylbenzamide?
The InChIKey is CMVDOSYBCPGSCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2OS/c1-14-10-11-16(23-4)12-17(14)19(22)20-13-18(21(2)3)15-8-6-5-7-9-15/h5-12,18H,13H2,1-4H3,(H,20,22).
What are the key properties of N-[2-(dimethylamino)-2-phenylethyl]-2-methyl-5-methylsulfanylbenzamide?
N-[2-(dimethylamino)-2-phenylethyl]-2-methyl-5-methylsulfanylbenzamide has a molecular weight of 328.48 g/mol, XLogP of 3.75, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-phenylethyl]-2-methyl-5-methylsulfanylbenzamide is sourced from PubChem (CID 134018244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).