N-[(2R)-2-(ethylamino)propyl]-4-[(4-methylphenyl)sulfonylmethyl]benzamide

C20H26N2O3S — CID 120654941

IUPACN-[(2R)-2-(ethylamino)propyl]-4-[(4-methylphenyl)sulfonylmethyl]benzamide
SMILESCCN[C@H](C)CNC(=O)c1ccc(CS(=O)(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C20H26N2O3S/c1-4-21-16(3)13-22-20(23)18-9-7-17(8-10-18)14-26(24,25)19-11-5-15(2)6-12-19/h5-12,16,21H,4,13-14H2,1-3H3,(H,22,23)/t16-/m1/s1
InChIKeyNRCMDYSYAZRPOA-MRXNPFEDSA-N
MW374.51 g/mol
LogP2.70
Rot. Bonds8

About N-[(2R)-2-(ethylamino)propyl]-4-[(4-methylphenyl)sulfonylmethyl]benzamide

N-[(2R)-2-(ethylamino)propyl]-4-[(4-methylphenyl)sulfonylmethyl]benzamide (PubChem CID 120654941) has the molecular formula C20H26N2O3S and a molecular weight of 374.51 g/mol. Its IUPAC name is N-[(2R)-2-(ethylamino)propyl]-4-[(4-methylphenyl)sulfonylmethyl]benzamide.

Molecular Properties

Compound NameN-[(2R)-2-(ethylamino)propyl]-4-[(4-methylphenyl)sulfonylmethyl]benzamide
PubChem CID120654941
Molecular FormulaC20H26N2O3S
Molecular Weight374.51 g/mol
Exact Mass374.17
IUPAC NameN-[(2R)-2-(ethylamino)propyl]-4-[(4-methylphenyl)sulfonylmethyl]benzamide
SMILESCCN[C@H](C)CNC(=O)c1ccc(CS(=O)(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C20H26N2O3S/c1-4-21-16(3)13-22-20(23)18-9-7-17(8-10-18)14-26(24,25)19-11-5-15(2)6-12-19/h5-12,16,21H,4,13-14H2,1-3H3,(H,22,23)/t16-/m1/s1
InChIKeyNRCMDYSYAZRPOA-MRXNPFEDSA-N
XLogP2.70
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.51
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(2R)-2-(ethylamino)propyl]-4-[(4-methylphenyl)sulfonylmethyl]benzamide 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

3-[[4-[(4-methylphenyl)sulfonylmethyl]benzoyl]amino]butanoic acid
CID 119220917
4-ethyl-N'-[4-[(4-methylphenyl)sulfonylmethyl]benzoyl]benzohydrazide
CID 78888892
N-[(2R)-2-(ethylamino)propyl]-1-(4-methylphenyl)sulfonylpyrrole-3-carboxamide
CID 120652815
N-(1-amino-3-methyl-1-oxopentan-2-yl)-4-[(4-methylphenyl)sulfonylmethyl]benzamide
CID 78889210
4-[(4-methylphenyl)methylsulfonyl]benzoic acid
CID 24705378
4-cyclopentylsulfonyl-N-[(2R)-2-(ethylamino)propyl]benzamide;hydrochloride
CID 120651710
N-[(2R)-2-(ethylamino)propyl]-4-(prop-2-enylsulfamoyl)benzamide
CID 120653889
4-(benzenesulfonamido)-N-[(2R)-2-(ethylamino)propyl]benzamide
CID 120653123
4-[(4-methylphenyl)sulfonylmethyl]-N-(pyridin-3-ylmethyl)benzamide
CID 87000480
N-(1-amino-2,3-dimethylbutan-2-yl)-4-[(4-methylphenyl)sulfonylmethyl]benzamide;hydrochloride
CID 119605692
4-N-(2,2-dimethylpropyl)-1-N-[(2R)-2-(ethylamino)propyl]benzene-1,4-dicarboxamide;hydrochloride
CID 120651678
N-[(2R)-2-(ethylamino)propyl]-2,4-dimethylbenzamide
CID 120653289

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(ethylamino)propyl]-4-[(4-methylphenyl)sulfonylmethyl]benzamide?
The IUPAC name of N-[(2R)-2-(ethylamino)propyl]-4-[(4-methylphenyl)sulfonylmethyl]benzamide (CID 120654941) is N-[(2R)-2-(ethylamino)propyl]-4-[(4-methylphenyl)sulfonylmethyl]benzamide.
What is the SMILES notation for N-[(2R)-2-(ethylamino)propyl]-4-[(4-methylphenyl)sulfonylmethyl]benzamide?
The canonical SMILES for N-[(2R)-2-(ethylamino)propyl]-4-[(4-methylphenyl)sulfonylmethyl]benzamide is CCN[C@H](C)CNC(=O)c1ccc(CS(=O)(=O)c2ccc(C)cc2)cc1.
What is the InChIKey of N-[(2R)-2-(ethylamino)propyl]-4-[(4-methylphenyl)sulfonylmethyl]benzamide?
The InChIKey is NRCMDYSYAZRPOA-MRXNPFEDSA-N. The full InChI is InChI=1S/C20H26N2O3S/c1-4-21-16(3)13-22-20(23)18-9-7-17(8-10-18)14-26(24,25)19-11-5-15(2)6-12-19/h5-12,16,21H,4,13-14H2,1-3H3,(H,22,23)/t16-/m1/s1.
What are the key properties of N-[(2R)-2-(ethylamino)propyl]-4-[(4-methylphenyl)sulfonylmethyl]benzamide?
N-[(2R)-2-(ethylamino)propyl]-4-[(4-methylphenyl)sulfonylmethyl]benzamide has a molecular weight of 374.51 g/mol, XLogP of 2.70, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(ethylamino)propyl]-4-[(4-methylphenyl)sulfonylmethyl]benzamide is sourced from PubChem (CID 120654941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).