N-(2,3-dichlorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide

C13H8Cl2N4O — CID 110864410

IUPACN-(2,3-dichlorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide
SMILESO=C(Nc1cccc(Cl)c1Cl)c1cnc2nc[nH]c2c1
InChIInChI=1S/C13H8Cl2N4O/c14-8-2-1-3-9(11(8)15)19-13(20)7-4-10-12(16-5-7)18-6-17-10/h1-6H,(H,19,20)(H,16,17,18)
InChIKeyXSOFRMJWYQJJFO-UHFFFAOYSA-N
MW307.14 g/mol
LogP3.52
Rot. Bonds2

About N-(2,3-dichlorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide

N-(2,3-dichlorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide (PubChem CID 110864410) has the molecular formula C13H8Cl2N4O and a molecular weight of 307.14 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide
PubChem CID110864410
Molecular FormulaC13H8Cl2N4O
Molecular Weight307.14 g/mol
Exact Mass306.01
IUPAC NameN-(2,3-dichlorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide
SMILESO=C(Nc1cccc(Cl)c1Cl)c1cnc2nc[nH]c2c1
InChIInChI=1S/C13H8Cl2N4O/c14-8-2-1-3-9(11(8)15)19-13(20)7-4-10-12(16-5-7)18-6-17-10/h1-6H,(H,19,20)(H,16,17,18)
InChIKeyXSOFRMJWYQJJFO-UHFFFAOYSA-N
XLogP3.52
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.14
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide?
The IUPAC name of N-(2,3-dichlorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide (CID 110864410) is N-(2,3-dichlorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide is O=C(Nc1cccc(Cl)c1Cl)c1cnc2nc[nH]c2c1.
What is the InChIKey of N-(2,3-dichlorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide?
The InChIKey is XSOFRMJWYQJJFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Cl2N4O/c14-8-2-1-3-9(11(8)15)19-13(20)7-4-10-12(16-5-7)18-6-17-10/h1-6H,(H,19,20)(H,16,17,18).
What are the key properties of N-(2,3-dichlorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide?
N-(2,3-dichlorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide has a molecular weight of 307.14 g/mol, XLogP of 3.52, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide is sourced from PubChem (CID 110864410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).