2-(ethylamino)-2-methyl-N-[2-methyl-5-(methylsulfamoyl)phenyl]propanamide

C14H23N3O3S — CID 62831773

IUPAC2-(ethylamino)-2-methyl-N-[2-methyl-5-(methylsulfamoyl)phenyl]propanamide
SMILESCCNC(C)(C)C(=O)Nc1cc(S(=O)(=O)NC)ccc1C
InChIInChI=1S/C14H23N3O3S/c1-6-16-14(3,4)13(18)17-12-9-11(8-7-10(12)2)21(19,20)15-5/h7-9,15-16H,6H2,1-5H3,(H,17,18)
InChIKeyHRYFVTSWVBMBFP-UHFFFAOYSA-N
MW313.42 g/mol
LogP1.23
Rot. Bonds6

About 2-(ethylamino)-2-methyl-N-[2-methyl-5-(methylsulfamoyl)phenyl]propanamide

2-(ethylamino)-2-methyl-N-[2-methyl-5-(methylsulfamoyl)phenyl]propanamide (PubChem CID 62831773) has the molecular formula C14H23N3O3S and a molecular weight of 313.42 g/mol. Its IUPAC name is 2-(ethylamino)-2-methyl-N-[2-methyl-5-(methylsulfamoyl)phenyl]propanamide.

Molecular Properties

Compound Name2-(ethylamino)-2-methyl-N-[2-methyl-5-(methylsulfamoyl)phenyl]propanamide
PubChem CID62831773
Molecular FormulaC14H23N3O3S
Molecular Weight313.42 g/mol
Exact Mass313.15
IUPAC Name2-(ethylamino)-2-methyl-N-[2-methyl-5-(methylsulfamoyl)phenyl]propanamide
SMILESCCNC(C)(C)C(=O)Nc1cc(S(=O)(=O)NC)ccc1C
InChIInChI=1S/C14H23N3O3S/c1-6-16-14(3,4)13(18)17-12-9-11(8-7-10(12)2)21(19,20)15-5/h7-9,15-16H,6H2,1-5H3,(H,17,18)
InChIKeyHRYFVTSWVBMBFP-UHFFFAOYSA-N
XLogP1.23
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.42
LogP ≤ 51.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2,2,2-trifluoro-N-[2-methyl-5-(methylsulfamoyl)phenyl]acetamide
CID 63374698
(2R)-2-amino-N-[2-methyl-5-(methylsulfamoyl)phenyl]pentanamide
CID 103795500
4-(methylamino)-N-[2-methyl-5-(methylsulfamoyl)phenyl]butanamide
CID 60841151
(2S)-2-amino-4-methyl-N-[2-methyl-5-(methylsulfamoyl)phenyl]pentanamide
CID 61155453
2-chloro-N-[2-methyl-5-(methylsulfamoyl)phenyl]propanamide
CID 43695768
N,4-dimethyl-3-(pentylamino)benzenesulfonamide
CID 43752016
2,2-dimethyl-N-(2-methyl-5-sulfamoylphenyl)butanamide
CID 55103402
N-[2-methyl-5-(methylsulfamoyl)phenyl]-2-propan-2-yloxyacetamide
CID 47413216
2-[methyl-(4-methylphenyl)sulfonylamino]-N-[2-methyl-5-(methylsulfamoyl)phenyl]acetamide
CID 100790294
4-[[2-(ethylamino)-2-methylpropanoyl]amino]-3-methylbenzoic acid
CID 62834340
2-(ethylamino)-2-methyl-N-(4-methylsulfonylphenyl)propanamide
CID 55121565
N-(2,5-dichloro-4-methylphenyl)-2-(ethylamino)-2-methylpropanamide
CID 104727045

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-2-methyl-N-[2-methyl-5-(methylsulfamoyl)phenyl]propanamide?
The IUPAC name of 2-(ethylamino)-2-methyl-N-[2-methyl-5-(methylsulfamoyl)phenyl]propanamide (CID 62831773) is 2-(ethylamino)-2-methyl-N-[2-methyl-5-(methylsulfamoyl)phenyl]propanamide.
What is the SMILES notation for 2-(ethylamino)-2-methyl-N-[2-methyl-5-(methylsulfamoyl)phenyl]propanamide?
The canonical SMILES for 2-(ethylamino)-2-methyl-N-[2-methyl-5-(methylsulfamoyl)phenyl]propanamide is CCNC(C)(C)C(=O)Nc1cc(S(=O)(=O)NC)ccc1C.
What is the InChIKey of 2-(ethylamino)-2-methyl-N-[2-methyl-5-(methylsulfamoyl)phenyl]propanamide?
The InChIKey is HRYFVTSWVBMBFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3S/c1-6-16-14(3,4)13(18)17-12-9-11(8-7-10(12)2)21(19,20)15-5/h7-9,15-16H,6H2,1-5H3,(H,17,18).
What are the key properties of 2-(ethylamino)-2-methyl-N-[2-methyl-5-(methylsulfamoyl)phenyl]propanamide?
2-(ethylamino)-2-methyl-N-[2-methyl-5-(methylsulfamoyl)phenyl]propanamide has a molecular weight of 313.42 g/mol, XLogP of 1.23, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-2-methyl-N-[2-methyl-5-(methylsulfamoyl)phenyl]propanamide is sourced from PubChem (CID 62831773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).