N-(2-cyanophenyl)-4-(morpholine-4-carbonyl)pyridine-2-carboxamide

C18H16N4O3 — CID 109082943

IUPACN-(2-cyanophenyl)-4-(morpholine-4-carbonyl)pyridine-2-carboxamide
SMILESN#Cc1ccccc1NC(=O)c1cc(C(=O)N2CCOCC2)ccn1
InChIInChI=1S/C18H16N4O3/c19-12-14-3-1-2-4-15(14)21-17(23)16-11-13(5-6-20-16)18(24)22-7-9-25-10-8-22/h1-6,11H,7-10H2,(H,21,23)
InChIKeyBEDAYHBKSPKPOL-UHFFFAOYSA-N
MW336.35 g/mol
LogP1.68
Rot. Bonds3

About N-(2-cyanophenyl)-4-(morpholine-4-carbonyl)pyridine-2-carboxamide

N-(2-cyanophenyl)-4-(morpholine-4-carbonyl)pyridine-2-carboxamide (PubChem CID 109082943) has the molecular formula C18H16N4O3 and a molecular weight of 336.35 g/mol. Its IUPAC name is N-(2-cyanophenyl)-4-(morpholine-4-carbonyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-4-(morpholine-4-carbonyl)pyridine-2-carboxamide
PubChem CID109082943
Molecular FormulaC18H16N4O3
Molecular Weight336.35 g/mol
Exact Mass336.12
IUPAC NameN-(2-cyanophenyl)-4-(morpholine-4-carbonyl)pyridine-2-carboxamide
SMILESN#Cc1ccccc1NC(=O)c1cc(C(=O)N2CCOCC2)ccn1
InChIInChI=1S/C18H16N4O3/c19-12-14-3-1-2-4-15(14)21-17(23)16-11-13(5-6-20-16)18(24)22-7-9-25-10-8-22/h1-6,11H,7-10H2,(H,21,23)
InChIKeyBEDAYHBKSPKPOL-UHFFFAOYSA-N
XLogP1.68
TPSA95.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.35
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,4-dichlorophenyl)-4-(morpholine-4-carbonyl)pyridine-2-carboxamide
CID 109082935
ethyl 2-[[4-(morpholine-4-carbonyl)pyridine-2-carbonyl]amino]benzoate
CID 109082942
2-N-(2-cyanophenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091043
N-(2-cyanophenyl)-2-(3-methylpiperidine-1-carbonyl)pyridine-4-carboxamide
CID 109090441
N-(2-chlorophenyl)-4-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 109080420
N-(4-fluorophenyl)-4-(morpholine-4-carbonyl)pyridine-2-carboxamide
CID 109082885
N-(3-acetylphenyl)-4-(morpholine-4-carbonyl)pyridine-2-carboxamide
CID 109082912
4-(2-cyanoanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide
CID 109222697
N-(2-methylphenyl)-4-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 109080395
N-(2-cyanophenyl)-2-(2-morpholin-4-ylethylamino)pyridine-4-carboxamide
CID 109168139
4-(4-acetylpiperazine-1-carbonyl)-N-(2-methylphenyl)pyridine-2-carboxamide
CID 109084885
4-N-(2-cyanophenyl)-2-N-(2,3,4-trifluorophenyl)pyridine-2,4-dicarboxamide
CID 109093370

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-4-(morpholine-4-carbonyl)pyridine-2-carboxamide?
The IUPAC name of N-(2-cyanophenyl)-4-(morpholine-4-carbonyl)pyridine-2-carboxamide (CID 109082943) is N-(2-cyanophenyl)-4-(morpholine-4-carbonyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(2-cyanophenyl)-4-(morpholine-4-carbonyl)pyridine-2-carboxamide?
The canonical SMILES for N-(2-cyanophenyl)-4-(morpholine-4-carbonyl)pyridine-2-carboxamide is N#Cc1ccccc1NC(=O)c1cc(C(=O)N2CCOCC2)ccn1.
What is the InChIKey of N-(2-cyanophenyl)-4-(morpholine-4-carbonyl)pyridine-2-carboxamide?
The InChIKey is BEDAYHBKSPKPOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O3/c19-12-14-3-1-2-4-15(14)21-17(23)16-11-13(5-6-20-16)18(24)22-7-9-25-10-8-22/h1-6,11H,7-10H2,(H,21,23).
What are the key properties of N-(2-cyanophenyl)-4-(morpholine-4-carbonyl)pyridine-2-carboxamide?
N-(2-cyanophenyl)-4-(morpholine-4-carbonyl)pyridine-2-carboxamide has a molecular weight of 336.35 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-4-(morpholine-4-carbonyl)pyridine-2-carboxamide is sourced from PubChem (CID 109082943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).