N-(4-cyanophenyl)-5-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide

C17H19N5O — CID 109185633

IUPACN-(4-cyanophenyl)-5-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide
SMILESCN(C)CCNc1ccc(C(=O)Nc2ccc(C#N)cc2)nc1
InChIInChI=1S/C17H19N5O/c1-22(2)10-9-19-15-7-8-16(20-12-15)17(23)21-14-5-3-13(11-18)4-6-14/h3-8,12,19H,9-10H2,1-2H3,(H,21,23)
InChIKeyQHKDRJNMSVAOQC-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.18
Rot. Bonds6

About N-(4-cyanophenyl)-5-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide

N-(4-cyanophenyl)-5-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide (PubChem CID 109185633) has the molecular formula C17H19N5O and a molecular weight of 309.37 g/mol. Its IUPAC name is N-(4-cyanophenyl)-5-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-5-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide
PubChem CID109185633
Molecular FormulaC17H19N5O
Molecular Weight309.37 g/mol
Exact Mass309.16
IUPAC NameN-(4-cyanophenyl)-5-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide
SMILESCN(C)CCNc1ccc(C(=O)Nc2ccc(C#N)cc2)nc1
InChIInChI=1S/C17H19N5O/c1-22(2)10-9-19-15-7-8-16(20-12-15)17(23)21-14-5-3-13(11-18)4-6-14/h3-8,12,19H,9-10H2,1-2H3,(H,21,23)
InChIKeyQHKDRJNMSVAOQC-UHFFFAOYSA-N
XLogP2.18
TPSA81.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-[2-(dimethylamino)ethylamino]-N-(4-methylphenyl)pyridine-2-carboxamide
CID 109185535
N-(4-tert-butylphenyl)-5-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide
CID 109185555
5-[2-(dimethylamino)ethylamino]-N-(3,5-dimethylphenyl)pyridine-2-carboxamide
CID 109185542
N-(4-cyanophenyl)-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide
CID 109115946
5-(4-cyanoanilino)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide
CID 109200559
5-(4-cyanoanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide
CID 109199006
5-(benzylamino)-N-(4-cyanophenyl)pyridine-2-carboxamide
CID 109188122
N-(4-bromophenyl)-5-[3-(dimethylamino)propylamino]pyridine-2-carboxamide
CID 109186187
N-(4-bromo-3-methylphenyl)-5-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide
CID 109185609
N-(4-cyanophenyl)-5-(propylamino)pyrazine-2-carboxamide
CID 109271147
N'-(4-cyanophenyl)-N-[2-(dimethylamino)ethyl]oxamide
CID 108519474
N-(2-tert-butylphenyl)-5-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide
CID 109185554

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-5-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide?
The IUPAC name of N-(4-cyanophenyl)-5-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide (CID 109185633) is N-(4-cyanophenyl)-5-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide.
What is the SMILES notation for N-(4-cyanophenyl)-5-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide?
The canonical SMILES for N-(4-cyanophenyl)-5-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide is CN(C)CCNc1ccc(C(=O)Nc2ccc(C#N)cc2)nc1.
What is the InChIKey of N-(4-cyanophenyl)-5-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide?
The InChIKey is QHKDRJNMSVAOQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O/c1-22(2)10-9-19-15-7-8-16(20-12-15)17(23)21-14-5-3-13(11-18)4-6-14/h3-8,12,19H,9-10H2,1-2H3,(H,21,23).
What are the key properties of N-(4-cyanophenyl)-5-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide?
N-(4-cyanophenyl)-5-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide has a molecular weight of 309.37 g/mol, XLogP of 2.18, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-5-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide is sourced from PubChem (CID 109185633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).