N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-(methylamino)acetamide

C15H23N3O4S — CID 119677452

IUPACN-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-(methylamino)acetamide
SMILESCNCC(=O)Nc1ccc(OC)c(S(=O)(=O)N2CCCCC2)c1
InChIInChI=1S/C15H23N3O4S/c1-16-11-15(19)17-12-6-7-13(22-2)14(10-12)23(20,21)18-8-4-3-5-9-18/h6-7,10,16H,3-5,8-9,11H2,1-2H3,(H,17,19)
InChIKeyQORNNYIBLIBWMT-UHFFFAOYSA-N
MW341.43 g/mol
LogP1.03
Rot. Bonds6

About N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-(methylamino)acetamide

N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-(methylamino)acetamide (PubChem CID 119677452) has the molecular formula C15H23N3O4S and a molecular weight of 341.43 g/mol. Its IUPAC name is N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-(methylamino)acetamide
PubChem CID119677452
Molecular FormulaC15H23N3O4S
Molecular Weight341.43 g/mol
Exact Mass341.14
IUPAC NameN-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-(methylamino)acetamide
SMILESCNCC(=O)Nc1ccc(OC)c(S(=O)(=O)N2CCCCC2)c1
InChIInChI=1S/C15H23N3O4S/c1-16-11-15(19)17-12-6-7-13(22-2)14(10-12)23(20,21)18-8-4-3-5-9-18/h6-7,10,16H,3-5,8-9,11H2,1-2H3,(H,17,19)
InChIKeyQORNNYIBLIBWMT-UHFFFAOYSA-N
XLogP1.03
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.43
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)propanamide
CID 26851836
2-(2-methoxyethylamino)-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)acetamide;hydrochloride
CID 119677471
N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-(methylamino)acetamide
CID 119675127
2-[2-(dimethylamino)ethylamino]-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)acetamide
CID 5024016
2-(2-methoxyphenyl)-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)acetamide
CID 4800928
N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-pyrrolidin-1-ium-1-ylacetamide
CID 8902019
4-amino-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)pentanamide
CID 120558840
2-[4-chloro-3-(trifluoromethyl)anilino]-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)acetamide
CID 4227752
3-(3,5-dimethoxyphenyl)-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)propanamide
CID 26588789
2-(2-hydroxyphenoxy)-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)acetamide
CID 8933983
1-tert-butyl-3-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)urea
CID 4803267
N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-morpholin-4-ium-4-ylacetamide
CID 8018316

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-(methylamino)acetamide?
The IUPAC name of N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-(methylamino)acetamide (CID 119677452) is N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-(methylamino)acetamide.
What is the SMILES notation for N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-(methylamino)acetamide?
The canonical SMILES for N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-(methylamino)acetamide is CNCC(=O)Nc1ccc(OC)c(S(=O)(=O)N2CCCCC2)c1.
What is the InChIKey of N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-(methylamino)acetamide?
The InChIKey is QORNNYIBLIBWMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O4S/c1-16-11-15(19)17-12-6-7-13(22-2)14(10-12)23(20,21)18-8-4-3-5-9-18/h6-7,10,16H,3-5,8-9,11H2,1-2H3,(H,17,19).
What are the key properties of N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-(methylamino)acetamide?
N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-(methylamino)acetamide has a molecular weight of 341.43 g/mol, XLogP of 1.03, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-(methylamino)acetamide is sourced from PubChem (CID 119677452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).