N-(5-cyano-2-pyridinyl)-N-methylpyridine-4-carboxamide

C13H10N4O — CID 115273544

IUPACN-(5-cyano-2-pyridinyl)-N-methylpyridine-4-carboxamide
SMILESCN(C(=O)c1ccncc1)c1ccc(C#N)cn1
InChIInChI=1S/C13H10N4O/c1-17(12-3-2-10(8-14)9-16-12)13(18)11-4-6-15-7-5-11/h2-7,9H,1H3
InChIKeyDKLNAMRSTBISQL-UHFFFAOYSA-N
MW238.25 g/mol
LogP1.62
Rot. Bonds2

About N-(5-cyano-2-pyridinyl)-N-methylpyridine-4-carboxamide

N-(5-cyano-2-pyridinyl)-N-methylpyridine-4-carboxamide (PubChem CID 115273544) has the molecular formula C13H10N4O and a molecular weight of 238.25 g/mol. Its IUPAC name is N-(5-cyano-2-pyridinyl)-N-methylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-(5-cyano-2-pyridinyl)-N-methylpyridine-4-carboxamide
PubChem CID115273544
Molecular FormulaC13H10N4O
Molecular Weight238.25 g/mol
Exact Mass238.09
IUPAC NameN-(5-cyano-2-pyridinyl)-N-methylpyridine-4-carboxamide
SMILESCN(C(=O)c1ccncc1)c1ccc(C#N)cn1
InChIInChI=1S/C13H10N4O/c1-17(12-3-2-10(8-14)9-16-12)13(18)11-4-6-15-7-5-11/h2-7,9H,1H3
InChIKeyDKLNAMRSTBISQL-UHFFFAOYSA-N
XLogP1.62
TPSA69.88 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-cyano-2-pyridinyl)-4-ethyl-N-methylbenzamide
CID 115273533
N-(5-cyano-2-pyridinyl)-N,2,2-trimethylpropanamide
CID 115268043
N-(5-cyano-2-pyridinyl)-2-ethyl-N-methylbutanamide
CID 115268044
3-(5-amino-6-chloro-3-pyridinyl)-N-(5-cyano-2-pyridinyl)-N-methylpyrazolo[1,5-a]pyridine-5-carboxamide
CID 90157076
N-(5-cyano-2-pyridinyl)-2-(4-fluorophenyl)-N-methylacetamide
CID 115268063
N-(5-cyano-2-pyridinyl)-3-cyclopentyl-N-methylpropanamide
CID 115273575
N-(4-cyanophenyl)-N-methylpyridazine-4-carboxamide
CID 104670312
6-[dimethylsulfamoyl(methyl)amino]pyridine-3-carbonitrile
CID 115268088
N-(4-cyanophenyl)-N-methyl-2-(methylamino)pyridine-4-carboxamide
CID 62970236
N-(4-cyanophenyl)-N-methylpyrazine-2-carboxamide
CID 113242357
6-bromo-N-(4-cyanophenyl)-N-methylpyridine-3-carboxamide
CID 66463352
N-(5-bromo-2-pyridinyl)-4-chloro-N-methylbenzamide
CID 115268312

Frequently Asked Questions

What is the IUPAC name of N-(5-cyano-2-pyridinyl)-N-methylpyridine-4-carboxamide?
The IUPAC name of N-(5-cyano-2-pyridinyl)-N-methylpyridine-4-carboxamide (CID 115273544) is N-(5-cyano-2-pyridinyl)-N-methylpyridine-4-carboxamide.
What is the SMILES notation for N-(5-cyano-2-pyridinyl)-N-methylpyridine-4-carboxamide?
The canonical SMILES for N-(5-cyano-2-pyridinyl)-N-methylpyridine-4-carboxamide is CN(C(=O)c1ccncc1)c1ccc(C#N)cn1.
What is the InChIKey of N-(5-cyano-2-pyridinyl)-N-methylpyridine-4-carboxamide?
The InChIKey is DKLNAMRSTBISQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N4O/c1-17(12-3-2-10(8-14)9-16-12)13(18)11-4-6-15-7-5-11/h2-7,9H,1H3.
What are the key properties of N-(5-cyano-2-pyridinyl)-N-methylpyridine-4-carboxamide?
N-(5-cyano-2-pyridinyl)-N-methylpyridine-4-carboxamide has a molecular weight of 238.25 g/mol, XLogP of 1.62, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyano-2-pyridinyl)-N-methylpyridine-4-carboxamide is sourced from PubChem (CID 115273544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).