N-(1,3-benzoxazol-6-yl)-4-cyanopyridine-2-carboxamide

C14H8N4O2 — CID 115116784

IUPACN-(1,3-benzoxazol-6-yl)-4-cyanopyridine-2-carboxamide
SMILESN#Cc1ccnc(C(=O)Nc2ccc3ncoc3c2)c1
InChIInChI=1S/C14H8N4O2/c15-7-9-3-4-16-12(5-9)14(19)18-10-1-2-11-13(6-10)20-8-17-11/h1-6,8H,(H,18,19)
InChIKeyRQZBNOZVWBGRIS-UHFFFAOYSA-N
MW264.24 g/mol
LogP2.35
Rot. Bonds2

About N-(1,3-benzoxazol-6-yl)-4-cyanopyridine-2-carboxamide

N-(1,3-benzoxazol-6-yl)-4-cyanopyridine-2-carboxamide (PubChem CID 115116784) has the molecular formula C14H8N4O2 and a molecular weight of 264.24 g/mol. Its IUPAC name is N-(1,3-benzoxazol-6-yl)-4-cyanopyridine-2-carboxamide.

Molecular Properties

Compound NameN-(1,3-benzoxazol-6-yl)-4-cyanopyridine-2-carboxamide
PubChem CID115116784
Molecular FormulaC14H8N4O2
Molecular Weight264.24 g/mol
Exact Mass264.06
IUPAC NameN-(1,3-benzoxazol-6-yl)-4-cyanopyridine-2-carboxamide
SMILESN#Cc1ccnc(C(=O)Nc2ccc3ncoc3c2)c1
InChIInChI=1S/C14H8N4O2/c15-7-9-3-4-16-12(5-9)14(19)18-10-1-2-11-13(6-10)20-8-17-11/h1-6,8H,(H,18,19)
InChIKeyRQZBNOZVWBGRIS-UHFFFAOYSA-N
XLogP2.35
TPSA91.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.24
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(1,3-benzoxazol-6-yl)-4-cyanopyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1,3-benzoxazol-6-yl)pyrazine-2-carboxamide
CID 110744615
N-(1,3-benzoxazol-6-yl)-1-cyanoformamide
CID 115171898
1,3-benzoxazol-6-ylcarbamic acid
CID 115170663
N-(1,3-benzoxazol-6-yl)pyridine-3-carboxamide;hydrochloride
CID 110778910
N-(1,3-benzoxazol-6-yl)-5-chloro-2-hydroxybenzamide
CID 175430925
N-(1,3-benzoxazol-6-yl)thiophene-2-carboxamide
CID 110728841
4-(4-cyanoanilino)-N-(3-cyanophenyl)pyridine-2-carboxamide
CID 109222713
N-(4-chlorophenyl)-1,3-benzoxazole-6-carboxamide
CID 110765115
N-(1,3-benzoxazol-6-yl)-2-chloro-6-fluorobenzamide
CID 110728878
4-N-(4-acetamidophenyl)-2-N-(3-cyanophenyl)pyridine-2,4-dicarboxamide
CID 109093227
N-(1,3-benzoxazol-6-yl)butanamide
CID 110728829
4-N-(3-cyanophenyl)-2-N-[4-(dimethylamino)phenyl]pyridine-2,4-dicarboxamide
CID 109093258

Frequently Asked Questions

What is the IUPAC name of N-(1,3-benzoxazol-6-yl)-4-cyanopyridine-2-carboxamide?
The IUPAC name of N-(1,3-benzoxazol-6-yl)-4-cyanopyridine-2-carboxamide (CID 115116784) is N-(1,3-benzoxazol-6-yl)-4-cyanopyridine-2-carboxamide.
What is the SMILES notation for N-(1,3-benzoxazol-6-yl)-4-cyanopyridine-2-carboxamide?
The canonical SMILES for N-(1,3-benzoxazol-6-yl)-4-cyanopyridine-2-carboxamide is N#Cc1ccnc(C(=O)Nc2ccc3ncoc3c2)c1.
What is the InChIKey of N-(1,3-benzoxazol-6-yl)-4-cyanopyridine-2-carboxamide?
The InChIKey is RQZBNOZVWBGRIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8N4O2/c15-7-9-3-4-16-12(5-9)14(19)18-10-1-2-11-13(6-10)20-8-17-11/h1-6,8H,(H,18,19).
What are the key properties of N-(1,3-benzoxazol-6-yl)-4-cyanopyridine-2-carboxamide?
N-(1,3-benzoxazol-6-yl)-4-cyanopyridine-2-carboxamide has a molecular weight of 264.24 g/mol, XLogP of 2.35, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-benzoxazol-6-yl)-4-cyanopyridine-2-carboxamide is sourced from PubChem (CID 115116784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).