2-(3-chloro-2-pyridinyl)imidazo[4,5-c]pyridine-1-carboxamide

C12H8ClN5O — CID 71222474

IUPAC2-(3-chloro-2-pyridinyl)imidazo[4,5-c]pyridine-1-carboxamide
SMILESNC(=O)n1c(-c2ncccc2Cl)nc2cnccc21
InChIInChI=1S/C12H8ClN5O/c13-7-2-1-4-16-10(7)11-17-8-6-15-5-3-9(8)18(11)12(14)19/h1-6H,(H2,14,19)
InChIKeyBQALFHMRNUISFB-UHFFFAOYSA-N
MW273.68 g/mol
LogP2.07
Rot. Bonds1

About 2-(3-chloro-2-pyridinyl)imidazo[4,5-c]pyridine-1-carboxamide

2-(3-chloro-2-pyridinyl)imidazo[4,5-c]pyridine-1-carboxamide (PubChem CID 71222474) has the molecular formula C12H8ClN5O and a molecular weight of 273.68 g/mol. Its IUPAC name is 2-(3-chloro-2-pyridinyl)imidazo[4,5-c]pyridine-1-carboxamide.

Molecular Properties

Compound Name2-(3-chloro-2-pyridinyl)imidazo[4,5-c]pyridine-1-carboxamide
PubChem CID71222474
Molecular FormulaC12H8ClN5O
Molecular Weight273.68 g/mol
Exact Mass273.04
IUPAC Name2-(3-chloro-2-pyridinyl)imidazo[4,5-c]pyridine-1-carboxamide
SMILESNC(=O)n1c(-c2ncccc2Cl)nc2cnccc21
InChIInChI=1S/C12H8ClN5O/c13-7-2-1-4-16-10(7)11-17-8-6-15-5-3-9(8)18(11)12(14)19/h1-6H,(H2,14,19)
InChIKeyBQALFHMRNUISFB-UHFFFAOYSA-N
XLogP2.07
TPSA86.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.68
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-2-pyridinyl)imidazo[4,5-c]pyridine-1-carboxamide?
The IUPAC name of 2-(3-chloro-2-pyridinyl)imidazo[4,5-c]pyridine-1-carboxamide (CID 71222474) is 2-(3-chloro-2-pyridinyl)imidazo[4,5-c]pyridine-1-carboxamide.
What is the SMILES notation for 2-(3-chloro-2-pyridinyl)imidazo[4,5-c]pyridine-1-carboxamide?
The canonical SMILES for 2-(3-chloro-2-pyridinyl)imidazo[4,5-c]pyridine-1-carboxamide is NC(=O)n1c(-c2ncccc2Cl)nc2cnccc21.
What is the InChIKey of 2-(3-chloro-2-pyridinyl)imidazo[4,5-c]pyridine-1-carboxamide?
The InChIKey is BQALFHMRNUISFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClN5O/c13-7-2-1-4-16-10(7)11-17-8-6-15-5-3-9(8)18(11)12(14)19/h1-6H,(H2,14,19).
What are the key properties of 2-(3-chloro-2-pyridinyl)imidazo[4,5-c]pyridine-1-carboxamide?
2-(3-chloro-2-pyridinyl)imidazo[4,5-c]pyridine-1-carboxamide has a molecular weight of 273.68 g/mol, XLogP of 2.07, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-2-pyridinyl)imidazo[4,5-c]pyridine-1-carboxamide is sourced from PubChem (CID 71222474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).