2-[3-(methanesulfonamido)piperidin-1-yl]-N-(3-methylphenyl)acetamide

C15H23N3O3S — CID 86982166

IUPAC2-[3-(methanesulfonamido)piperidin-1-yl]-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)CN2CCCC(NS(C)(=O)=O)C2)c1
InChIInChI=1S/C15H23N3O3S/c1-12-5-3-6-13(9-12)16-15(19)11-18-8-4-7-14(10-18)17-22(2,20)21/h3,5-6,9,14,17H,4,7-8,10-11H2,1-2H3,(H,16,19)
InChIKeyFSGZNKYCOSFBNL-UHFFFAOYSA-N
MW325.43 g/mol
LogP0.95
Rot. Bonds5

About 2-[3-(methanesulfonamido)piperidin-1-yl]-N-(3-methylphenyl)acetamide

2-[3-(methanesulfonamido)piperidin-1-yl]-N-(3-methylphenyl)acetamide (PubChem CID 86982166) has the molecular formula C15H23N3O3S and a molecular weight of 325.43 g/mol. Its IUPAC name is 2-[3-(methanesulfonamido)piperidin-1-yl]-N-(3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[3-(methanesulfonamido)piperidin-1-yl]-N-(3-methylphenyl)acetamide
PubChem CID86982166
Molecular FormulaC15H23N3O3S
Molecular Weight325.43 g/mol
Exact Mass325.15
IUPAC Name2-[3-(methanesulfonamido)piperidin-1-yl]-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)CN2CCCC(NS(C)(=O)=O)C2)c1
InChIInChI=1S/C15H23N3O3S/c1-12-5-3-6-13(9-12)16-15(19)11-18-8-4-7-14(10-18)17-22(2,20)21/h3,5-6,9,14,17H,4,7-8,10-11H2,1-2H3,(H,16,19)
InChIKeyFSGZNKYCOSFBNL-UHFFFAOYSA-N
XLogP0.95
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.43
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[3-(methanesulfonamido)piperidin-1-yl]-N-(4-methylphenyl)acetamide
CID 163352401
2-[(3R)-3-hydroxypiperidin-1-yl]-N-(3-methylphenyl)acetamide
CID 129367068
2-(azocan-1-yl)-N-(3-methylphenyl)acetamide
CID 2655272
2-[3-(aminomethyl)piperidin-1-yl]-N-(3-methylphenyl)acetamide;hydrochloride
CID 119915581
3-[(3R)-3-(methanesulfonamido)piperidin-1-yl]-N-phenylpropanamide
CID 95159240
4-(methanesulfonamido)-N-(3-methylphenyl)piperidine-1-carboxamide
CID 41430122
2-[3-(ethylaminomethyl)piperidin-1-yl]-N-(3-methylphenyl)acetamide
CID 63848456
2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-N-(3-methylphenyl)acetamide
CID 155981782
4-[3-(methylamino)piperidin-1-yl]-N-(3-methylphenyl)butanamide
CID 62546343
N-(3-methylphenyl)-2-[3-(phenoxymethyl)piperidin-1-yl]acetamide
CID 86972186
N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
CID 62545829
N-(3-iodophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride
CID 119919334

Frequently Asked Questions

What is the IUPAC name of 2-[3-(methanesulfonamido)piperidin-1-yl]-N-(3-methylphenyl)acetamide?
The IUPAC name of 2-[3-(methanesulfonamido)piperidin-1-yl]-N-(3-methylphenyl)acetamide (CID 86982166) is 2-[3-(methanesulfonamido)piperidin-1-yl]-N-(3-methylphenyl)acetamide.
What is the SMILES notation for 2-[3-(methanesulfonamido)piperidin-1-yl]-N-(3-methylphenyl)acetamide?
The canonical SMILES for 2-[3-(methanesulfonamido)piperidin-1-yl]-N-(3-methylphenyl)acetamide is Cc1cccc(NC(=O)CN2CCCC(NS(C)(=O)=O)C2)c1.
What is the InChIKey of 2-[3-(methanesulfonamido)piperidin-1-yl]-N-(3-methylphenyl)acetamide?
The InChIKey is FSGZNKYCOSFBNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3S/c1-12-5-3-6-13(9-12)16-15(19)11-18-8-4-7-14(10-18)17-22(2,20)21/h3,5-6,9,14,17H,4,7-8,10-11H2,1-2H3,(H,16,19).
What are the key properties of 2-[3-(methanesulfonamido)piperidin-1-yl]-N-(3-methylphenyl)acetamide?
2-[3-(methanesulfonamido)piperidin-1-yl]-N-(3-methylphenyl)acetamide has a molecular weight of 325.43 g/mol, XLogP of 0.95, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(methanesulfonamido)piperidin-1-yl]-N-(3-methylphenyl)acetamide is sourced from PubChem (CID 86982166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).