N-(2,2-difluoroethyl)-6-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide

C21H17F2N5O — CID 122478560

IUPACN-(2,2-difluoroethyl)-6-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1cccc(-c2ncccc2-c2ccc3ncc(C(=O)NCC(F)F)n3c2)n1
InChIInChI=1S/C21H17F2N5O/c1-13-4-2-6-16(27-13)20-15(5-3-9-24-20)14-7-8-19-25-10-17(28(19)12-14)21(29)26-11-18(22)23/h2-10,12,18H,11H2,1H3,(H,26,29)
InChIKeyBCIZTVUZIPWHOT-UHFFFAOYSA-N
MW393.40 g/mol
LogP3.76
Rot. Bonds5

About N-(2,2-difluoroethyl)-6-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide

N-(2,2-difluoroethyl)-6-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 122478560) has the molecular formula C21H17F2N5O and a molecular weight of 393.40 g/mol. Its IUPAC name is N-(2,2-difluoroethyl)-6-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,2-difluoroethyl)-6-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID122478560
Molecular FormulaC21H17F2N5O
Molecular Weight393.40 g/mol
Exact Mass393.14
IUPAC NameN-(2,2-difluoroethyl)-6-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1cccc(-c2ncccc2-c2ccc3ncc(C(=O)NCC(F)F)n3c2)n1
InChIInChI=1S/C21H17F2N5O/c1-13-4-2-6-16(27-13)20-15(5-3-9-24-20)14-7-8-19-25-10-17(28(19)12-14)21(29)26-11-18(22)23/h2-10,12,18H,11H2,1H3,(H,26,29)
InChIKeyBCIZTVUZIPWHOT-UHFFFAOYSA-N
XLogP3.76
TPSA72.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.40
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(2,2-difluoroethyl)-6-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2,2-difluoroethyl)-6-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-(2,2-difluoroethyl)-6-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide (CID 122478560) is N-(2,2-difluoroethyl)-6-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-(2,2-difluoroethyl)-6-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-(2,2-difluoroethyl)-6-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide is Cc1cccc(-c2ncccc2-c2ccc3ncc(C(=O)NCC(F)F)n3c2)n1.
What is the InChIKey of N-(2,2-difluoroethyl)-6-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is BCIZTVUZIPWHOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17F2N5O/c1-13-4-2-6-16(27-13)20-15(5-3-9-24-20)14-7-8-19-25-10-17(28(19)12-14)21(29)26-11-18(22)23/h2-10,12,18H,11H2,1H3,(H,26,29).
What are the key properties of N-(2,2-difluoroethyl)-6-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide?
N-(2,2-difluoroethyl)-6-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 393.40 g/mol, XLogP of 3.76, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-difluoroethyl)-6-[2-(6-methyl-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 122478560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).