N-[2-(2-chlorophenyl)ethyl]-3-fluoroimidazo[1,2-a]pyridine-2-carboxamide

C16H13ClFN3O — CID 77079749

IUPACN-[2-(2-chlorophenyl)ethyl]-3-fluoroimidazo[1,2-a]pyridine-2-carboxamide
SMILESO=C(NCCc1ccccc1Cl)c1nc2ccccn2c1F
InChIInChI=1S/C16H13ClFN3O/c17-12-6-2-1-5-11(12)8-9-19-16(22)14-15(18)21-10-4-3-7-13(21)20-14/h1-7,10H,8-9H2,(H,19,22)
InChIKeySSLZKTVRLHZDLR-UHFFFAOYSA-N
MW317.75 g/mol
LogP3.10
Rot. Bonds4

About N-[2-(2-chlorophenyl)ethyl]-3-fluoroimidazo[1,2-a]pyridine-2-carboxamide

N-[2-(2-chlorophenyl)ethyl]-3-fluoroimidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 77079749) has the molecular formula C16H13ClFN3O and a molecular weight of 317.75 g/mol. Its IUPAC name is N-[2-(2-chlorophenyl)ethyl]-3-fluoroimidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-chlorophenyl)ethyl]-3-fluoroimidazo[1,2-a]pyridine-2-carboxamide
PubChem CID77079749
Molecular FormulaC16H13ClFN3O
Molecular Weight317.75 g/mol
Exact Mass317.07
IUPAC NameN-[2-(2-chlorophenyl)ethyl]-3-fluoroimidazo[1,2-a]pyridine-2-carboxamide
SMILESO=C(NCCc1ccccc1Cl)c1nc2ccccn2c1F
InChIInChI=1S/C16H13ClFN3O/c17-12-6-2-1-5-11(12)8-9-19-16(22)14-15(18)21-10-4-3-7-13(21)20-14/h1-7,10H,8-9H2,(H,19,22)
InChIKeySSLZKTVRLHZDLR-UHFFFAOYSA-N
XLogP3.10
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.75
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-fluorophenyl)-N-(3-methoxypropyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 87051675
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CID 72853923
N-[2-(2-chlorophenyl)ethyl]-1-phenylpyrazole-4-carboxamide
CID 50772841
3-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-(3-methoxypropyl)propanamide
CID 53118553
2-chloro-N-(2-naphthalen-1-ylethyl)benzamide
CID 46434104
3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-(2-fluorophenyl)propanamide
CID 20974346
3-(4-chlorophenyl)-N-[2-(4-ethylpiperazin-1-yl)ethyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 87051665
1-[(2-chlorophenyl)methyl]-6-oxo-N-[2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl]pyridine-3-carboxamide
CID 18128601
N-[(2-chlorophenyl)methyl]-3-methylimidazo[1,5-a]pyridine-1-carboxamide
CID 110648110
N-[2-(2-chlorophenyl)ethyl]-2-methyl-3-pyrazol-1-ylpropanamide
CID 131905264
3-[2-[(2-chloroimidazo[1,2-a]pyridine-3-carbonyl)amino]ethyl]benzoic acid
CID 99781385
3-N-[2-(2-fluorophenyl)ethyl]-1-N-(2-methoxyethyl)imidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109068890

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-chlorophenyl)ethyl]-3-fluoroimidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-[2-(2-chlorophenyl)ethyl]-3-fluoroimidazo[1,2-a]pyridine-2-carboxamide (CID 77079749) is N-[2-(2-chlorophenyl)ethyl]-3-fluoroimidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-[2-(2-chlorophenyl)ethyl]-3-fluoroimidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-[2-(2-chlorophenyl)ethyl]-3-fluoroimidazo[1,2-a]pyridine-2-carboxamide is O=C(NCCc1ccccc1Cl)c1nc2ccccn2c1F.
What is the InChIKey of N-[2-(2-chlorophenyl)ethyl]-3-fluoroimidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is SSLZKTVRLHZDLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClFN3O/c17-12-6-2-1-5-11(12)8-9-19-16(22)14-15(18)21-10-4-3-7-13(21)20-14/h1-7,10H,8-9H2,(H,19,22).
What are the key properties of N-[2-(2-chlorophenyl)ethyl]-3-fluoroimidazo[1,2-a]pyridine-2-carboxamide?
N-[2-(2-chlorophenyl)ethyl]-3-fluoroimidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 317.75 g/mol, XLogP of 3.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-chlorophenyl)ethyl]-3-fluoroimidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 77079749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).