N-(2,4-dichlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridine-3-carboxamide

C16H18Cl2N4O — CID 109153838

IUPACN-(2,4-dichlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridine-3-carboxamide
SMILESCN(C)CCNc1ccc(C(=O)Nc2ccc(Cl)cc2Cl)cn1
InChIInChI=1S/C16H18Cl2N4O/c1-22(2)8-7-19-15-6-3-11(10-20-15)16(23)21-14-5-4-12(17)9-13(14)18/h3-6,9-10H,7-8H2,1-2H3,(H,19,20)(H,21,23)
InChIKeyWWFYZJSKKWBOLT-UHFFFAOYSA-N
MW353.25 g/mol
LogP3.61
Rot. Bonds6

About N-(2,4-dichlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridine-3-carboxamide

N-(2,4-dichlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridine-3-carboxamide (PubChem CID 109153838) has the molecular formula C16H18Cl2N4O and a molecular weight of 353.25 g/mol. Its IUPAC name is N-(2,4-dichlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-dichlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridine-3-carboxamide
PubChem CID109153838
Molecular FormulaC16H18Cl2N4O
Molecular Weight353.25 g/mol
Exact Mass352.09
IUPAC NameN-(2,4-dichlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridine-3-carboxamide
SMILESCN(C)CCNc1ccc(C(=O)Nc2ccc(Cl)cc2Cl)cn1
InChIInChI=1S/C16H18Cl2N4O/c1-22(2)8-7-19-15-6-3-11(10-20-15)16(23)21-14-5-4-12(17)9-13(14)18/h3-6,9-10H,7-8H2,1-2H3,(H,19,20)(H,21,23)
InChIKeyWWFYZJSKKWBOLT-UHFFFAOYSA-N
XLogP3.61
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.25
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-chloro-2-(trifluoromethyl)phenyl]-6-[2-(dimethylamino)ethylamino]pyridine-3-carboxamide
CID 109153836
N-(2,4-dichlorophenyl)-2-[2-(dimethylamino)ethylamino]pyridine-4-carboxamide
CID 109167896
N-(2,4-dichlorophenyl)-6-(2-morpholin-4-ylethylamino)pyridine-3-carboxamide
CID 109154085
N-(2,4-dichlorophenyl)-6-(pyridin-3-ylmethylamino)pyridine-3-carboxamide
CID 109157918
4-chloro-N-[6-[2-(dimethylamino)ethylamino]pyridazin-3-yl]benzamide
CID 113039930
N-(2-chloro-4-iodophenyl)-6-(ethylamino)pyridine-3-carboxamide
CID 107606045
N-(5-chloro-2-methylphenyl)-6-(ethylamino)pyridine-3-carboxamide
CID 62184893
6-[2-(dimethylamino)ethylamino]-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide
CID 109153720
N-(4-chloro-3-pyridin-2-ylphenyl)-6-[2-(dimethylamino)ethylamino]pyridine-3-carboxamide
CID 58614711
4-tert-butyl-N-(2,4-dichlorophenyl)benzamide
CID 773784
4-tert-butyl-N-[6-[2-(dimethylamino)ethylamino]-3-pyridinyl]benzamide
CID 113010730
N-[4-chloro-2-(trifluoromethyl)phenyl]-6-(3-methylbutylamino)pyridine-3-carboxamide
CID 109161212

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dichlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridine-3-carboxamide?
The IUPAC name of N-(2,4-dichlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridine-3-carboxamide (CID 109153838) is N-(2,4-dichlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridine-3-carboxamide.
What is the SMILES notation for N-(2,4-dichlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridine-3-carboxamide?
The canonical SMILES for N-(2,4-dichlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridine-3-carboxamide is CN(C)CCNc1ccc(C(=O)Nc2ccc(Cl)cc2Cl)cn1.
What is the InChIKey of N-(2,4-dichlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridine-3-carboxamide?
The InChIKey is WWFYZJSKKWBOLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18Cl2N4O/c1-22(2)8-7-19-15-6-3-11(10-20-15)16(23)21-14-5-4-12(17)9-13(14)18/h3-6,9-10H,7-8H2,1-2H3,(H,19,20)(H,21,23).
What are the key properties of N-(2,4-dichlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridine-3-carboxamide?
N-(2,4-dichlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridine-3-carboxamide has a molecular weight of 353.25 g/mol, XLogP of 3.61, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dichlorophenyl)-6-[2-(dimethylamino)ethylamino]pyridine-3-carboxamide is sourced from PubChem (CID 109153838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).