N-methyl-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]methanesulfonamide

C15H22N2O3S — CID 900491

IUPACN-methyl-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]methanesulfonamide
SMILESCC1CCN(C(=O)c2ccc(N(C)S(C)(=O)=O)cc2)CC1
InChIInChI=1S/C15H22N2O3S/c1-12-8-10-17(11-9-12)15(18)13-4-6-14(7-5-13)16(2)21(3,19)20/h4-7,12H,8-11H2,1-3H3
InChIKeyODUNTLYYWALYHK-UHFFFAOYSA-N
MW310.42 g/mol
LogP1.95
Rot. Bonds3

About N-methyl-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]methanesulfonamide

N-methyl-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]methanesulfonamide (PubChem CID 900491) has the molecular formula C15H22N2O3S and a molecular weight of 310.42 g/mol. Its IUPAC name is N-methyl-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]methanesulfonamide.

Molecular Properties

Compound NameN-methyl-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]methanesulfonamide
PubChem CID900491
Molecular FormulaC15H22N2O3S
Molecular Weight310.42 g/mol
Exact Mass310.14
IUPAC NameN-methyl-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]methanesulfonamide
SMILESCC1CCN(C(=O)c2ccc(N(C)S(C)(=O)=O)cc2)CC1
InChIInChI=1S/C15H22N2O3S/c1-12-8-10-17(11-9-12)15(18)13-4-6-14(7-5-13)16(2)21(3,19)20/h4-7,12H,8-11H2,1-3H3
InChIKeyODUNTLYYWALYHK-UHFFFAOYSA-N
XLogP1.95
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-methyl-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]methanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]methanesulfonamide?
The IUPAC name of N-methyl-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]methanesulfonamide (CID 900491) is N-methyl-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]methanesulfonamide.
What is the SMILES notation for N-methyl-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]methanesulfonamide?
The canonical SMILES for N-methyl-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]methanesulfonamide is CC1CCN(C(=O)c2ccc(N(C)S(C)(=O)=O)cc2)CC1.
What is the InChIKey of N-methyl-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]methanesulfonamide?
The InChIKey is ODUNTLYYWALYHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3S/c1-12-8-10-17(11-9-12)15(18)13-4-6-14(7-5-13)16(2)21(3,19)20/h4-7,12H,8-11H2,1-3H3.
What are the key properties of N-methyl-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]methanesulfonamide?
N-methyl-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]methanesulfonamide has a molecular weight of 310.42 g/mol, XLogP of 1.95, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]methanesulfonamide is sourced from PubChem (CID 900491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).