6-chloro-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-carboxamide

C14H20ClN3O — CID 60724487

IUPAC6-chloro-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-carboxamide
SMILESCCN1CCC(N(C)C(=O)c2ccc(Cl)nc2)CC1
InChIInChI=1S/C14H20ClN3O/c1-3-18-8-6-12(7-9-18)17(2)14(19)11-4-5-13(15)16-10-11/h4-5,10,12H,3,6-9H2,1-2H3
InChIKeyULAGLYPJEZKQFM-UHFFFAOYSA-N
MW281.79 g/mol
LogP2.29
Rot. Bonds3

About 6-chloro-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-carboxamide

6-chloro-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-carboxamide (PubChem CID 60724487) has the molecular formula C14H20ClN3O and a molecular weight of 281.79 g/mol. Its IUPAC name is 6-chloro-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-carboxamide
PubChem CID60724487
Molecular FormulaC14H20ClN3O
Molecular Weight281.79 g/mol
Exact Mass281.13
IUPAC Name6-chloro-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-carboxamide
SMILESCCN1CCC(N(C)C(=O)c2ccc(Cl)nc2)CC1
InChIInChI=1S/C14H20ClN3O/c1-3-18-8-6-12(7-9-18)17(2)14(19)11-4-5-13(15)16-10-11/h4-5,10,12H,3,6-9H2,1-2H3
InChIKeyULAGLYPJEZKQFM-UHFFFAOYSA-N
XLogP2.29
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.79
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 6-chloro-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

2,6-dichloro-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-carboxamide
CID 106993273
6-chloro-N-methyl-N-(4-phenylcyclohexyl)pyridine-3-carboxamide
CID 134022024
3-bromo-4-chloro-N-(1-ethylpiperidin-4-yl)-N-methylbenzamide
CID 103841606
6-fluoro-N-methyl-N-(1-propylpiperidin-4-yl)pyridine-3-carboxamide
CID 63978585
N-(1-ethylpiperidin-4-yl)-N-methylthiophene-3-carboxamide
CID 60559786
5,6-dichloro-N-methyl-N-(1-propylpiperidin-4-yl)pyridine-3-carboxamide
CID 61051847
3-amino-N-(1-ethylpiperidin-4-yl)-4-fluoro-N-methylbenzamide
CID 43574421
2,6-dichloro-N-methyl-N-(1-propylpiperidin-4-yl)pyridine-4-carboxamide
CID 61044792
N-(1-ethylpiperidin-4-yl)-3-hydroxy-N-methylpyridine-2-carboxamide
CID 55002979
(6-chloro-3-pyridinyl) 1-ethylpiperidine-4-carboxylate
CID 175375194
6-chloro-N-methyl-N-propylpyridine-3-carboxamide
CID 43271303
N-(1-ethylpiperidin-4-yl)-2-hydroxy-N-methylbenzamide
CID 55002980

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-carboxamide?
The IUPAC name of 6-chloro-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-carboxamide (CID 60724487) is 6-chloro-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-carboxamide?
The canonical SMILES for 6-chloro-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-carboxamide is CCN1CCC(N(C)C(=O)c2ccc(Cl)nc2)CC1.
What is the InChIKey of 6-chloro-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-carboxamide?
The InChIKey is ULAGLYPJEZKQFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClN3O/c1-3-18-8-6-12(7-9-18)17(2)14(19)11-4-5-13(15)16-10-11/h4-5,10,12H,3,6-9H2,1-2H3.
What are the key properties of 6-chloro-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-carboxamide?
6-chloro-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-carboxamide has a molecular weight of 281.79 g/mol, XLogP of 2.29, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(1-ethylpiperidin-4-yl)-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 60724487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).