3-[(3R)-3-(methanesulfonamido)piperidin-1-yl]-N-phenylpropanamide

C15H23N3O3S — CID 95159240

IUPAC3-[(3R)-3-(methanesulfonamido)piperidin-1-yl]-N-phenylpropanamide
SMILESCS(=O)(=O)N[C@@H]1CCCN(CCC(=O)Nc2ccccc2)C1
InChIInChI=1S/C15H23N3O3S/c1-22(20,21)17-14-8-5-10-18(12-14)11-9-15(19)16-13-6-3-2-4-7-13/h2-4,6-7,14,17H,5,8-12H2,1H3,(H,16,19)/t14-/m1/s1
InChIKeyXEVUDTBVFSDXKF-CQSZACIVSA-N
MW325.43 g/mol
LogP1.03
Rot. Bonds6

About 3-[(3R)-3-(methanesulfonamido)piperidin-1-yl]-N-phenylpropanamide

3-[(3R)-3-(methanesulfonamido)piperidin-1-yl]-N-phenylpropanamide (PubChem CID 95159240) has the molecular formula C15H23N3O3S and a molecular weight of 325.43 g/mol. Its IUPAC name is 3-[(3R)-3-(methanesulfonamido)piperidin-1-yl]-N-phenylpropanamide.

Molecular Properties

Compound Name3-[(3R)-3-(methanesulfonamido)piperidin-1-yl]-N-phenylpropanamide
PubChem CID95159240
Molecular FormulaC15H23N3O3S
Molecular Weight325.43 g/mol
Exact Mass325.15
IUPAC Name3-[(3R)-3-(methanesulfonamido)piperidin-1-yl]-N-phenylpropanamide
SMILESCS(=O)(=O)N[C@@H]1CCCN(CCC(=O)Nc2ccccc2)C1
InChIInChI=1S/C15H23N3O3S/c1-22(20,21)17-14-8-5-10-18(12-14)11-9-15(19)16-13-6-3-2-4-7-13/h2-4,6-7,14,17H,5,8-12H2,1H3,(H,16,19)/t14-/m1/s1
InChIKeyXEVUDTBVFSDXKF-CQSZACIVSA-N
XLogP1.03
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.43
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(3S)-3-methylpiperidin-1-yl]-N-phenylpropanamide
CID 739976
2-[3-(methanesulfonamido)piperidin-1-yl]-N-(4-methylphenyl)acetamide
CID 163352401
2-[3-(methanesulfonamido)piperidin-1-yl]-N-(3-methylphenyl)acetamide
CID 86982166
3-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride
CID 119919395
N-(4-acetylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide
CID 119919130
3-(3-hydroxyazetidin-1-yl)-N-phenylpropanamide
CID 63282500
3-[3-(benzenesulfonamido)piperidin-1-yl]propanoic acid;hydrochloride
CID 56802015
3-(3-methylpiperidin-1-yl)-N-(4-phenoxyphenyl)propanamide
CID 109032975
2-(3-acetamidopiperidin-1-yl)-N-phenylacetamide
CID 60503649
3-(3,5-dimethylpiperidin-1-yl)-N-phenylpropanamide;hydrochloride
CID 126467812
3-(4-methylpiperazin-1-yl)-N-phenylpropanamide
CID 719539
3-(3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-phenylpropanamide
CID 81491276

Frequently Asked Questions

What is the IUPAC name of 3-[(3R)-3-(methanesulfonamido)piperidin-1-yl]-N-phenylpropanamide?
The IUPAC name of 3-[(3R)-3-(methanesulfonamido)piperidin-1-yl]-N-phenylpropanamide (CID 95159240) is 3-[(3R)-3-(methanesulfonamido)piperidin-1-yl]-N-phenylpropanamide.
What is the SMILES notation for 3-[(3R)-3-(methanesulfonamido)piperidin-1-yl]-N-phenylpropanamide?
The canonical SMILES for 3-[(3R)-3-(methanesulfonamido)piperidin-1-yl]-N-phenylpropanamide is CS(=O)(=O)N[C@@H]1CCCN(CCC(=O)Nc2ccccc2)C1.
What is the InChIKey of 3-[(3R)-3-(methanesulfonamido)piperidin-1-yl]-N-phenylpropanamide?
The InChIKey is XEVUDTBVFSDXKF-CQSZACIVSA-N. The full InChI is InChI=1S/C15H23N3O3S/c1-22(20,21)17-14-8-5-10-18(12-14)11-9-15(19)16-13-6-3-2-4-7-13/h2-4,6-7,14,17H,5,8-12H2,1H3,(H,16,19)/t14-/m1/s1.
What are the key properties of 3-[(3R)-3-(methanesulfonamido)piperidin-1-yl]-N-phenylpropanamide?
3-[(3R)-3-(methanesulfonamido)piperidin-1-yl]-N-phenylpropanamide has a molecular weight of 325.43 g/mol, XLogP of 1.03, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3R)-3-(methanesulfonamido)piperidin-1-yl]-N-phenylpropanamide is sourced from PubChem (CID 95159240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).