N,N-dimethyl-4-(2-methylanilino)piperidine-1-sulfonamide

C14H23N3O2S — CID 51106183

IUPACN,N-dimethyl-4-(2-methylanilino)piperidine-1-sulfonamide
SMILESCc1ccccc1NC1CCN(S(=O)(=O)N(C)C)CC1
InChIInChI=1S/C14H23N3O2S/c1-12-6-4-5-7-14(12)15-13-8-10-17(11-9-13)20(18,19)16(2)3/h4-7,13,15H,8-11H2,1-3H3
InChIKeyGLNSQLYOEMTFPM-UHFFFAOYSA-N
MW297.42 g/mol
LogP1.68
Rot. Bonds4

About N,N-dimethyl-4-(2-methylanilino)piperidine-1-sulfonamide

N,N-dimethyl-4-(2-methylanilino)piperidine-1-sulfonamide (PubChem CID 51106183) has the molecular formula C14H23N3O2S and a molecular weight of 297.42 g/mol. Its IUPAC name is N,N-dimethyl-4-(2-methylanilino)piperidine-1-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-4-(2-methylanilino)piperidine-1-sulfonamide
PubChem CID51106183
Molecular FormulaC14H23N3O2S
Molecular Weight297.42 g/mol
Exact Mass297.15
IUPAC NameN,N-dimethyl-4-(2-methylanilino)piperidine-1-sulfonamide
SMILESCc1ccccc1NC1CCN(S(=O)(=O)N(C)C)CC1
InChIInChI=1S/C14H23N3O2S/c1-12-6-4-5-7-14(12)15-13-8-10-17(11-9-13)20(18,19)16(2)3/h4-7,13,15H,8-11H2,1-3H3
InChIKeyGLNSQLYOEMTFPM-UHFFFAOYSA-N
XLogP1.68
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(2-methylanilino)piperidine-1-sulfonamide?
The IUPAC name of N,N-dimethyl-4-(2-methylanilino)piperidine-1-sulfonamide (CID 51106183) is N,N-dimethyl-4-(2-methylanilino)piperidine-1-sulfonamide.
What is the SMILES notation for N,N-dimethyl-4-(2-methylanilino)piperidine-1-sulfonamide?
The canonical SMILES for N,N-dimethyl-4-(2-methylanilino)piperidine-1-sulfonamide is Cc1ccccc1NC1CCN(S(=O)(=O)N(C)C)CC1.
What is the InChIKey of N,N-dimethyl-4-(2-methylanilino)piperidine-1-sulfonamide?
The InChIKey is GLNSQLYOEMTFPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S/c1-12-6-4-5-7-14(12)15-13-8-10-17(11-9-13)20(18,19)16(2)3/h4-7,13,15H,8-11H2,1-3H3.
What are the key properties of N,N-dimethyl-4-(2-methylanilino)piperidine-1-sulfonamide?
N,N-dimethyl-4-(2-methylanilino)piperidine-1-sulfonamide has a molecular weight of 297.42 g/mol, XLogP of 1.68, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(2-methylanilino)piperidine-1-sulfonamide is sourced from PubChem (CID 51106183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).