N-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]acetamide

C16H18N2O3S — CID 730422

IUPACN-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccccc2)cc1
InChIInChI=1S/C16H18N2O3S/c1-12(14-6-4-3-5-7-14)18-22(20,21)16-10-8-15(9-11-16)17-13(2)19/h3-12,18H,1-2H3,(H,17,19)/t12-/m0/s1
InChIKeyDRHLUFDEXCRIKI-LBPRGKRZSA-N
MW318.40 g/mol
LogP2.68
Rot. Bonds5

About N-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]acetamide

N-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]acetamide (PubChem CID 730422) has the molecular formula C16H18N2O3S and a molecular weight of 318.40 g/mol. Its IUPAC name is N-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]acetamide
PubChem CID730422
Molecular FormulaC16H18N2O3S
Molecular Weight318.40 g/mol
Exact Mass318.10
IUPAC NameN-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccccc2)cc1
InChIInChI=1S/C16H18N2O3S/c1-12(14-6-4-3-5-7-14)18-22(20,21)16-10-8-15(9-11-16)17-13(2)19/h3-12,18H,1-2H3,(H,17,19)/t12-/m0/s1
InChIKeyDRHLUFDEXCRIKI-LBPRGKRZSA-N
XLogP2.68
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.40
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[1-(4-propan-2-ylphenyl)ethylsulfamoyl]phenyl]acetamide
CID 22201175
4-acetyl-N-[(1S)-1-phenylethyl]benzenesulfonamide
CID 2416651
(2R)-2-[(4-acetamidophenyl)sulfonylamino]-2-phenylacetate
CID 6942072
N-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenyl]pyrrolidine-1-carboxamide
CID 7369582
N-(1-phenylethyl)-4-(1,2,2-tricyanoethenylamino)benzenesulfonamide
CID 168608712
N-(1-phenylethyl)benzenesulfonamide;hydrochloride
CID 70281153
N-[4-[[(4-methylphenyl)-phenylmethyl]sulfamoyl]phenyl]acetamide
CID 78686932
N-[4-[1-(3,4-dichlorophenyl)ethylsulfamoyl]phenyl]acetamide
CID 42999054
N-(4-acetamidophenyl)-2-(benzenesulfonamido)propanamide
CID 4240198
2-[(4-acetamidophenyl)sulfonylamino]propanoic acid
CID 3393223
N-methyl-4-[[(1R)-1-phenylethyl]sulfamoyl]benzamide
CID 27299317
N-phenyl-3-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]propanamide
CID 1007033

Frequently Asked Questions

What is the IUPAC name of N-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]acetamide (CID 730422) is N-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)c2ccccc2)cc1.
What is the InChIKey of N-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]acetamide?
The InChIKey is DRHLUFDEXCRIKI-LBPRGKRZSA-N. The full InChI is InChI=1S/C16H18N2O3S/c1-12(14-6-4-3-5-7-14)18-22(20,21)16-10-8-15(9-11-16)17-13(2)19/h3-12,18H,1-2H3,(H,17,19)/t12-/m0/s1.
What are the key properties of N-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]acetamide?
N-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]acetamide has a molecular weight of 318.40 g/mol, XLogP of 2.68, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 730422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).