4-[2-(methanesulfonamido)ethyl]-N-(4-propan-2-ylphenyl)benzamide

C19H24N2O3S — CID 27007439

IUPAC4-[2-(methanesulfonamido)ethyl]-N-(4-propan-2-ylphenyl)benzamide
SMILESCC(C)c1ccc(NC(=O)c2ccc(CCNS(C)(=O)=O)cc2)cc1
InChIInChI=1S/C19H24N2O3S/c1-14(2)16-8-10-18(11-9-16)21-19(22)17-6-4-15(5-7-17)12-13-20-25(3,23)24/h4-11,14,20H,12-13H2,1-3H3,(H,21,22)
InChIKeyPBGHRHFHNVYMBD-UHFFFAOYSA-N
MW360.48 g/mol
LogP3.15
Rot. Bonds7

About 4-[2-(methanesulfonamido)ethyl]-N-(4-propan-2-ylphenyl)benzamide

4-[2-(methanesulfonamido)ethyl]-N-(4-propan-2-ylphenyl)benzamide (PubChem CID 27007439) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is 4-[2-(methanesulfonamido)ethyl]-N-(4-propan-2-ylphenyl)benzamide.

Molecular Properties

Compound Name4-[2-(methanesulfonamido)ethyl]-N-(4-propan-2-ylphenyl)benzamide
PubChem CID27007439
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC Name4-[2-(methanesulfonamido)ethyl]-N-(4-propan-2-ylphenyl)benzamide
SMILESCC(C)c1ccc(NC(=O)c2ccc(CCNS(C)(=O)=O)cc2)cc1
InChIInChI=1S/C19H24N2O3S/c1-14(2)16-8-10-18(11-9-16)21-19(22)17-6-4-15(5-7-17)12-13-20-25(3,23)24/h4-11,14,20H,12-13H2,1-3H3,(H,21,22)
InChIKeyPBGHRHFHNVYMBD-UHFFFAOYSA-N
XLogP3.15
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide
CID 22109501
4-[2-(methanesulfonamido)ethyl]-N-[1-(4-propan-2-ylphenyl)ethyl]benzamide
CID 42921742
N-(4-fluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide
CID 18100481
4-[2-(methanesulfonamido)ethyl]-N-(4-phenoxyphenyl)benzamide
CID 27006017
4-propan-2-yl-N-(4-propan-2-ylphenyl)benzamide
CID 1406437
3-[4-[(4-propan-2-ylphenyl)carbamoyl]phenyl]propanoic acid
CID 28760251
4-[2-(methanesulfonamido)ethyl]-N-[(1S)-1-pyridin-4-ylethyl]benzamide
CID 30480070
4-[2-(methanesulfonamido)ethyl]-N-[(2R)-2-phenylpropyl]benzamide
CID 27017885
3-(4-chlorophenyl)-3-[[4-[2-(methanesulfonamido)ethyl]benzoyl]amino]propanoic acid
CID 167882502
N-(9H-fluoren-3-yl)-4-[2-(methanesulfonamido)ethyl]benzamide
CID 25483410
4-[(carbamoylamino)methyl]-N-(4-propan-2-ylphenyl)benzamide
CID 35018877
4-(ethylamino)-N-(4-propan-2-ylphenyl)benzamide
CID 62171719

Frequently Asked Questions

What is the IUPAC name of 4-[2-(methanesulfonamido)ethyl]-N-(4-propan-2-ylphenyl)benzamide?
The IUPAC name of 4-[2-(methanesulfonamido)ethyl]-N-(4-propan-2-ylphenyl)benzamide (CID 27007439) is 4-[2-(methanesulfonamido)ethyl]-N-(4-propan-2-ylphenyl)benzamide.
What is the SMILES notation for 4-[2-(methanesulfonamido)ethyl]-N-(4-propan-2-ylphenyl)benzamide?
The canonical SMILES for 4-[2-(methanesulfonamido)ethyl]-N-(4-propan-2-ylphenyl)benzamide is CC(C)c1ccc(NC(=O)c2ccc(CCNS(C)(=O)=O)cc2)cc1.
What is the InChIKey of 4-[2-(methanesulfonamido)ethyl]-N-(4-propan-2-ylphenyl)benzamide?
The InChIKey is PBGHRHFHNVYMBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-14(2)16-8-10-18(11-9-16)21-19(22)17-6-4-15(5-7-17)12-13-20-25(3,23)24/h4-11,14,20H,12-13H2,1-3H3,(H,21,22).
What are the key properties of 4-[2-(methanesulfonamido)ethyl]-N-(4-propan-2-ylphenyl)benzamide?
4-[2-(methanesulfonamido)ethyl]-N-(4-propan-2-ylphenyl)benzamide has a molecular weight of 360.48 g/mol, XLogP of 3.15, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(methanesulfonamido)ethyl]-N-(4-propan-2-ylphenyl)benzamide is sourced from PubChem (CID 27007439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).