3-cyclopentyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]propanamide

C16H24N2O3S — CID 8895164

IUPAC3-cyclopentyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]propanamide
SMILESC[C@H](NC(=O)CCC1CCCC1)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C16H24N2O3S/c1-12(14-7-9-15(10-8-14)22(17,20)21)18-16(19)11-6-13-4-2-3-5-13/h7-10,12-13H,2-6,11H2,1H3,(H,18,19)(H2,17,20,21)/t12-/m0/s1
InChIKeyCBUUEEADQDJFGU-LBPRGKRZSA-N
MW324.45 g/mol
LogP2.48
Rot. Bonds6

About 3-cyclopentyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]propanamide

3-cyclopentyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]propanamide (PubChem CID 8895164) has the molecular formula C16H24N2O3S and a molecular weight of 324.45 g/mol. Its IUPAC name is 3-cyclopentyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]propanamide.

Molecular Properties

Compound Name3-cyclopentyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]propanamide
PubChem CID8895164
Molecular FormulaC16H24N2O3S
Molecular Weight324.45 g/mol
Exact Mass324.15
IUPAC Name3-cyclopentyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]propanamide
SMILESC[C@H](NC(=O)CCC1CCCC1)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C16H24N2O3S/c1-12(14-7-9-15(10-8-14)22(17,20)21)18-16(19)11-6-13-4-2-3-5-13/h7-10,12-13H,2-6,11H2,1H3,(H,18,19)(H2,17,20,21)/t12-/m0/s1
InChIKeyCBUUEEADQDJFGU-LBPRGKRZSA-N
XLogP2.48
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.45
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-[1-(4-sulfamoylphenyl)ethyl]propanamide
CID 43702371
3-cyclohexyl-N-[(4-sulfamoylphenyl)methyl]propanamide
CID 2431253
4-oxo-4-phenyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]butanamide
CID 41023431
4-[1-(cyclohexylamino)ethyl]benzenesulfonamide
CID 43681895
N-propan-2-yl-2-[1-(4-sulfamoylphenyl)ethylamino]acetamide
CID 43218255
1-propan-2-yl-3-[(1S)-1-(4-sulfamoylphenyl)ethyl]urea
CID 25362862
3-(benzenesulfonamido)-N-[1-(4-sulfamoylphenyl)ethyl]propanamide
CID 43005594
2-[(2S)-2-phenylpyrrolidin-1-yl]-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]acetamide
CID 124739814
[2-oxo-2-[[(1R)-1-(4-sulfamoylphenyl)ethyl]amino]ethyl] (2S)-oxolane-2-carboxylate
CID 8808144
3,3-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]propanamide
CID 4793818
2-[2-oxo-2-[1-(4-sulfamoylphenyl)ethylamino]ethoxy]acetic acid
CID 60708265
3-cyclopentyl-N-methyl-N-(4-sulfamoylphenyl)propanamide
CID 61130763

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]propanamide?
The IUPAC name of 3-cyclopentyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]propanamide (CID 8895164) is 3-cyclopentyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]propanamide.
What is the SMILES notation for 3-cyclopentyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]propanamide?
The canonical SMILES for 3-cyclopentyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]propanamide is C[C@H](NC(=O)CCC1CCCC1)c1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of 3-cyclopentyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]propanamide?
The InChIKey is CBUUEEADQDJFGU-LBPRGKRZSA-N. The full InChI is InChI=1S/C16H24N2O3S/c1-12(14-7-9-15(10-8-14)22(17,20)21)18-16(19)11-6-13-4-2-3-5-13/h7-10,12-13H,2-6,11H2,1H3,(H,18,19)(H2,17,20,21)/t12-/m0/s1.
What are the key properties of 3-cyclopentyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]propanamide?
3-cyclopentyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]propanamide has a molecular weight of 324.45 g/mol, XLogP of 2.48, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]propanamide is sourced from PubChem (CID 8895164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).