4-(2-chlorophenyl)-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-4-oxobutanamide

C19H18ClN3O2 — CID 110630905

IUPAC4-(2-chlorophenyl)-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-4-oxobutanamide
SMILESO=C(CCC(=O)c1ccccc1Cl)NCCc1ncc2ccccn12
InChIInChI=1S/C19H18ClN3O2/c20-16-7-2-1-6-15(16)17(24)8-9-19(25)21-11-10-18-22-13-14-5-3-4-12-23(14)18/h1-7,12-13H,8-11H2,(H,21,25)
InChIKeyUPIPAXDPPWEDAJ-UHFFFAOYSA-N
MW355.83 g/mol
LogP3.31
Rot. Bonds7

About 4-(2-chlorophenyl)-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-4-oxobutanamide

4-(2-chlorophenyl)-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-4-oxobutanamide (PubChem CID 110630905) has the molecular formula C19H18ClN3O2 and a molecular weight of 355.83 g/mol. Its IUPAC name is 4-(2-chlorophenyl)-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-4-oxobutanamide.

Molecular Properties

Compound Name4-(2-chlorophenyl)-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-4-oxobutanamide
PubChem CID110630905
Molecular FormulaC19H18ClN3O2
Molecular Weight355.83 g/mol
Exact Mass355.11
IUPAC Name4-(2-chlorophenyl)-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-4-oxobutanamide
SMILESO=C(CCC(=O)c1ccccc1Cl)NCCc1ncc2ccccn12
InChIInChI=1S/C19H18ClN3O2/c20-16-7-2-1-6-15(16)17(24)8-9-19(25)21-11-10-18-22-13-14-5-3-4-12-23(14)18/h1-7,12-13H,8-11H2,(H,21,25)
InChIKeyUPIPAXDPPWEDAJ-UHFFFAOYSA-N
XLogP3.31
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.83
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-4-(4-methylphenyl)-4-oxobutanamide
CID 110309579
N-(2-acetamidoethyl)-3-imidazo[1,5-a]pyridin-3-ylpropanamide
CID 110675061
3-bromo-4-chloro-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)benzamide
CID 110630921
N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-4-methyl-3-phenylpentanamide
CID 110313770
3-imidazo[1,5-a]pyridin-3-yl-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
CID 110675048
4-(2-chlorophenyl)-N-[2-(2-hydroxyphenyl)ethyl]-4-oxobutanamide
CID 110614901
3-(4-fluorophenyl)-N-(3-imidazo[1,5-a]pyridin-3-ylpropyl)propanamide
CID 110630927
4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)butanamide
CID 110354647
N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-6-oxo-1H-pyridine-3-carboxamide
CID 110630880
2-(dimethylamino)-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-2-phenylacetamide
CID 110630830
4-(2-chlorophenyl)-4-oxo-N-(3-pyridin-3-ylpropyl)butanamide
CID 110607164
2-(2,4-dichlorophenoxy)-N-(imidazo[1,5-a]pyridin-3-ylmethyl)acetamide
CID 112500571

Frequently Asked Questions

What is the IUPAC name of 4-(2-chlorophenyl)-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-4-oxobutanamide?
The IUPAC name of 4-(2-chlorophenyl)-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-4-oxobutanamide (CID 110630905) is 4-(2-chlorophenyl)-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-4-oxobutanamide.
What is the SMILES notation for 4-(2-chlorophenyl)-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-4-oxobutanamide?
The canonical SMILES for 4-(2-chlorophenyl)-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-4-oxobutanamide is O=C(CCC(=O)c1ccccc1Cl)NCCc1ncc2ccccn12.
What is the InChIKey of 4-(2-chlorophenyl)-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-4-oxobutanamide?
The InChIKey is UPIPAXDPPWEDAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClN3O2/c20-16-7-2-1-6-15(16)17(24)8-9-19(25)21-11-10-18-22-13-14-5-3-4-12-23(14)18/h1-7,12-13H,8-11H2,(H,21,25).
What are the key properties of 4-(2-chlorophenyl)-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-4-oxobutanamide?
4-(2-chlorophenyl)-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-4-oxobutanamide has a molecular weight of 355.83 g/mol, XLogP of 3.31, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chlorophenyl)-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-4-oxobutanamide is sourced from PubChem (CID 110630905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).