N-(2-methoxy-5-piperidin-1-ylphenyl)-1-(2-methylphenyl)methanesulfonamide

C20H26N2O3S — CID 110359721

IUPACN-(2-methoxy-5-piperidin-1-ylphenyl)-1-(2-methylphenyl)methanesulfonamide
SMILESCOc1ccc(N2CCCCC2)cc1NS(=O)(=O)Cc1ccccc1C
InChIInChI=1S/C20H26N2O3S/c1-16-8-4-5-9-17(16)15-26(23,24)21-19-14-18(10-11-20(19)25-2)22-12-6-3-7-13-22/h4-5,8-11,14,21H,3,6-7,12-13,15H2,1-2H3
InChIKeySWDMZXDBCIVHSE-UHFFFAOYSA-N
MW374.51 g/mol
LogP3.94
Rot. Bonds6

About N-(2-methoxy-5-piperidin-1-ylphenyl)-1-(2-methylphenyl)methanesulfonamide

N-(2-methoxy-5-piperidin-1-ylphenyl)-1-(2-methylphenyl)methanesulfonamide (PubChem CID 110359721) has the molecular formula C20H26N2O3S and a molecular weight of 374.51 g/mol. Its IUPAC name is N-(2-methoxy-5-piperidin-1-ylphenyl)-1-(2-methylphenyl)methanesulfonamide.

Molecular Properties

Compound NameN-(2-methoxy-5-piperidin-1-ylphenyl)-1-(2-methylphenyl)methanesulfonamide
PubChem CID110359721
Molecular FormulaC20H26N2O3S
Molecular Weight374.51 g/mol
Exact Mass374.17
IUPAC NameN-(2-methoxy-5-piperidin-1-ylphenyl)-1-(2-methylphenyl)methanesulfonamide
SMILESCOc1ccc(N2CCCCC2)cc1NS(=O)(=O)Cc1ccccc1C
InChIInChI=1S/C20H26N2O3S/c1-16-8-4-5-9-17(16)15-26(23,24)21-19-14-18(10-11-20(19)25-2)22-12-6-3-7-13-22/h4-5,8-11,14,21H,3,6-7,12-13,15H2,1-2H3
InChIKeySWDMZXDBCIVHSE-UHFFFAOYSA-N
XLogP3.94
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.51
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

1-(4-fluorophenyl)-N-(2-methoxy-5-piperidin-1-ylphenyl)methanesulfonamide
CID 110359724
N-(2-methoxy-5-piperidin-1-ylphenyl)benzenesulfonamide
CID 110359707
2-(2-methoxyethoxy)-N-(2-methoxy-5-piperidin-1-ylphenyl)ethanesulfonamide
CID 110613184
N-(2-methoxy-5-pyrrolidin-1-ylphenyl)-3,4-dimethylbenzenesulfonamide
CID 110362056
2-methoxy-N-(2-methoxy-5-pyrrolidin-1-ylphenyl)-5-methylbenzenesulfonamide
CID 110362064
4-fluoro-N-(2-methoxy-5-piperidin-1-ylphenyl)benzenesulfonamide
CID 110359709
2-(2-fluorophenyl)-N-(2-methoxy-5-morpholin-4-ylphenyl)ethanesulfonamide
CID 110357313
N-[5-(4-formylpiperazin-1-yl)-2-methoxyphenyl]-2-methylbenzenesulfonamide
CID 110604584
N-(2-methoxy-5-piperidin-1-ylphenyl)-1,3-benzodioxole-5-sulfonamide
CID 110359714
4-acetyl-N-(2-methoxy-5-piperidin-1-ylphenyl)benzenesulfonamide
CID 110359732
N-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)methanesulfonamide
CID 110776517
1-(2-methylphenyl)-N-(3-morpholin-4-ylphenyl)methanesulfonamide
CID 110362407

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-piperidin-1-ylphenyl)-1-(2-methylphenyl)methanesulfonamide?
The IUPAC name of N-(2-methoxy-5-piperidin-1-ylphenyl)-1-(2-methylphenyl)methanesulfonamide (CID 110359721) is N-(2-methoxy-5-piperidin-1-ylphenyl)-1-(2-methylphenyl)methanesulfonamide.
What is the SMILES notation for N-(2-methoxy-5-piperidin-1-ylphenyl)-1-(2-methylphenyl)methanesulfonamide?
The canonical SMILES for N-(2-methoxy-5-piperidin-1-ylphenyl)-1-(2-methylphenyl)methanesulfonamide is COc1ccc(N2CCCCC2)cc1NS(=O)(=O)Cc1ccccc1C.
What is the InChIKey of N-(2-methoxy-5-piperidin-1-ylphenyl)-1-(2-methylphenyl)methanesulfonamide?
The InChIKey is SWDMZXDBCIVHSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3S/c1-16-8-4-5-9-17(16)15-26(23,24)21-19-14-18(10-11-20(19)25-2)22-12-6-3-7-13-22/h4-5,8-11,14,21H,3,6-7,12-13,15H2,1-2H3.
What are the key properties of N-(2-methoxy-5-piperidin-1-ylphenyl)-1-(2-methylphenyl)methanesulfonamide?
N-(2-methoxy-5-piperidin-1-ylphenyl)-1-(2-methylphenyl)methanesulfonamide has a molecular weight of 374.51 g/mol, XLogP of 3.94, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-5-piperidin-1-ylphenyl)-1-(2-methylphenyl)methanesulfonamide is sourced from PubChem (CID 110359721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).