N-[(2-chloro-6-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide

C16H13ClFN3O — CID 4878432

IUPACN-[(2-chloro-6-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCN(Cc1c(F)cccc1Cl)C(=O)c1cn2ccccc2n1
InChIInChI=1S/C16H13ClFN3O/c1-20(9-11-12(17)5-4-6-13(11)18)16(22)14-10-21-8-3-2-7-15(21)19-14/h2-8,10H,9H2,1H3
InChIKeyWUNBTDNZKKBNPX-UHFFFAOYSA-N
MW317.75 g/mol
LogP3.40
Rot. Bonds3

About N-[(2-chloro-6-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide

N-[(2-chloro-6-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 4878432) has the molecular formula C16H13ClFN3O and a molecular weight of 317.75 g/mol. Its IUPAC name is N-[(2-chloro-6-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(2-chloro-6-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide
PubChem CID4878432
Molecular FormulaC16H13ClFN3O
Molecular Weight317.75 g/mol
Exact Mass317.07
IUPAC NameN-[(2-chloro-6-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCN(Cc1c(F)cccc1Cl)C(=O)c1cn2ccccc2n1
InChIInChI=1S/C16H13ClFN3O/c1-20(9-11-12(17)5-4-6-13(11)18)16(22)14-10-21-8-3-2-7-15(21)19-14/h2-8,10H,9H2,1H3
InChIKeyWUNBTDNZKKBNPX-UHFFFAOYSA-N
XLogP3.40
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.75
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2-chloro-6-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-[(2-chloro-6-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide (CID 4878432) is N-[(2-chloro-6-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-[(2-chloro-6-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-[(2-chloro-6-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide is CN(Cc1c(F)cccc1Cl)C(=O)c1cn2ccccc2n1.
What is the InChIKey of N-[(2-chloro-6-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is WUNBTDNZKKBNPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClFN3O/c1-20(9-11-12(17)5-4-6-13(11)18)16(22)14-10-21-8-3-2-7-15(21)19-14/h2-8,10H,9H2,1H3.
What are the key properties of N-[(2-chloro-6-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide?
N-[(2-chloro-6-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 317.75 g/mol, XLogP of 3.40, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chloro-6-fluorophenyl)methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 4878432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).