N-(2-cyanophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide

C18H14N4O2 — CID 109231622

IUPACN-(2-cyanophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
SMILESN#Cc1ccccc1NC(=O)c1cncc(NCc2ccco2)c1
InChIInChI=1S/C18H14N4O2/c19-9-13-4-1-2-6-17(13)22-18(23)14-8-15(11-20-10-14)21-12-16-5-3-7-24-16/h1-8,10-11,21H,12H2,(H,22,23)
InChIKeyGEAKSYWKWZVVSE-UHFFFAOYSA-N
MW318.34 g/mol
LogP3.41
Rot. Bonds5

About N-(2-cyanophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide

N-(2-cyanophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide (PubChem CID 109231622) has the molecular formula C18H14N4O2 and a molecular weight of 318.34 g/mol. Its IUPAC name is N-(2-cyanophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
PubChem CID109231622
Molecular FormulaC18H14N4O2
Molecular Weight318.34 g/mol
Exact Mass318.11
IUPAC NameN-(2-cyanophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
SMILESN#Cc1ccccc1NC(=O)c1cncc(NCc2ccco2)c1
InChIInChI=1S/C18H14N4O2/c19-9-13-4-1-2-6-17(13)22-18(23)14-8-15(11-20-10-14)21-12-16-5-3-7-24-16/h1-8,10-11,21H,12H2,(H,22,23)
InChIKeyGEAKSYWKWZVVSE-UHFFFAOYSA-N
XLogP3.41
TPSA90.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.34
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-ethylphenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109231536
5-(furan-2-ylmethylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 109231573
5-(furan-2-ylmethylamino)-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
CID 109231540
5-(furan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109231568
5-[(2-chlorophenyl)methylamino]-N-(2-cyanophenyl)pyridine-3-carboxamide
CID 109233966
N-(2-cyanophenyl)-5-[(4-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109232741
N-(2,4-difluorophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109231606
N-(3,5-dichlorophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109231615
N-(3,4-difluorophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109231628
N-(4-chloro-2,5-dimethoxyphenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109231618
N-[4-(diethylamino)phenyl]-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109231586
5-(furan-2-ylmethylamino)-N-propylpyridine-3-carboxamide
CID 109222782

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide?
The IUPAC name of N-(2-cyanophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide (CID 109231622) is N-(2-cyanophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-cyanophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(2-cyanophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide is N#Cc1ccccc1NC(=O)c1cncc(NCc2ccco2)c1.
What is the InChIKey of N-(2-cyanophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide?
The InChIKey is GEAKSYWKWZVVSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4O2/c19-9-13-4-1-2-6-17(13)22-18(23)14-8-15(11-20-10-14)21-12-16-5-3-7-24-16/h1-8,10-11,21H,12H2,(H,22,23).
What are the key properties of N-(2-cyanophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide?
N-(2-cyanophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide has a molecular weight of 318.34 g/mol, XLogP of 3.41, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109231622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).