6-(aminomethyl)-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-sulfonamide

C14H24N4O2S — CID 114613188

IUPAC6-(aminomethyl)-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-sulfonamide
SMILESCCN1CCC(N(C)S(=O)(=O)c2ccc(CN)nc2)CC1
InChIInChI=1S/C14H24N4O2S/c1-3-18-8-6-13(7-9-18)17(2)21(19,20)14-5-4-12(10-15)16-11-14/h4-5,11,13H,3,6-10,15H2,1-2H3
InChIKeyVOQFOSLUGZQUTC-UHFFFAOYSA-N
MW312.44 g/mol
LogP0.65
Rot. Bonds5

About 6-(aminomethyl)-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-sulfonamide

6-(aminomethyl)-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-sulfonamide (PubChem CID 114613188) has the molecular formula C14H24N4O2S and a molecular weight of 312.44 g/mol. Its IUPAC name is 6-(aminomethyl)-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-sulfonamide.

Molecular Properties

Compound Name6-(aminomethyl)-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-sulfonamide
PubChem CID114613188
Molecular FormulaC14H24N4O2S
Molecular Weight312.44 g/mol
Exact Mass312.16
IUPAC Name6-(aminomethyl)-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-sulfonamide
SMILESCCN1CCC(N(C)S(=O)(=O)c2ccc(CN)nc2)CC1
InChIInChI=1S/C14H24N4O2S/c1-3-18-8-6-13(7-9-18)17(2)21(19,20)14-5-4-12(10-15)16-11-14/h4-5,11,13H,3,6-10,15H2,1-2H3
InChIKeyVOQFOSLUGZQUTC-UHFFFAOYSA-N
XLogP0.65
TPSA79.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.44
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-(aminomethyl)-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-sulfonamide 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 6-(aminomethyl)-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-sulfonamide?
The IUPAC name of 6-(aminomethyl)-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-sulfonamide (CID 114613188) is 6-(aminomethyl)-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-sulfonamide.
What is the SMILES notation for 6-(aminomethyl)-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-sulfonamide?
The canonical SMILES for 6-(aminomethyl)-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-sulfonamide is CCN1CCC(N(C)S(=O)(=O)c2ccc(CN)nc2)CC1.
What is the InChIKey of 6-(aminomethyl)-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-sulfonamide?
The InChIKey is VOQFOSLUGZQUTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2S/c1-3-18-8-6-13(7-9-18)17(2)21(19,20)14-5-4-12(10-15)16-11-14/h4-5,11,13H,3,6-10,15H2,1-2H3.
What are the key properties of 6-(aminomethyl)-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-sulfonamide?
6-(aminomethyl)-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-sulfonamide has a molecular weight of 312.44 g/mol, XLogP of 0.65, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-sulfonamide is sourced from PubChem (CID 114613188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).