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

C20H22ClN3O — CID 110309721

IUPAC3-(4-chlorophenyl)-N-(3-imidazo[1,5-a]pyridin-3-ylpropyl)-2-methylpropanamide
SMILESCC(Cc1ccc(Cl)cc1)C(=O)NCCCc1ncc2ccccn12
InChIInChI=1S/C20H22ClN3O/c1-15(13-16-7-9-17(21)10-8-16)20(25)22-11-4-6-19-23-14-18-5-2-3-12-24(18)19/h2-3,5,7-10,12,14-15H,4,6,11,13H2,1H3,(H,22,25)
InChIKeyADRSUZLPJKGMBJ-UHFFFAOYSA-N
MW355.87 g/mol
LogP3.92
Rot. Bonds7

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

3-(4-chlorophenyl)-N-(3-imidazo[1,5-a]pyridin-3-ylpropyl)-2-methylpropanamide (PubChem CID 110309721) has the molecular formula C20H22ClN3O and a molecular weight of 355.87 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-N-(3-imidazo[1,5-a]pyridin-3-ylpropyl)-2-methylpropanamide.

Molecular Properties

Compound Name3-(4-chlorophenyl)-N-(3-imidazo[1,5-a]pyridin-3-ylpropyl)-2-methylpropanamide
PubChem CID110309721
Molecular FormulaC20H22ClN3O
Molecular Weight355.87 g/mol
Exact Mass355.15
IUPAC Name3-(4-chlorophenyl)-N-(3-imidazo[1,5-a]pyridin-3-ylpropyl)-2-methylpropanamide
SMILESCC(Cc1ccc(Cl)cc1)C(=O)NCCCc1ncc2ccccn12
InChIInChI=1S/C20H22ClN3O/c1-15(13-16-7-9-17(21)10-8-16)20(25)22-11-4-6-19-23-14-18-5-2-3-12-24(18)19/h2-3,5,7-10,12,14-15H,4,6,11,13H2,1H3,(H,22,25)
InChIKeyADRSUZLPJKGMBJ-UHFFFAOYSA-N
XLogP3.92
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.87
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-imidazo[1,5-a]pyridin-3-ylpropyl)-2,2-diphenylacetamide
CID 112500611
1-butan-2-yl-3-(3-imidazo[1,5-a]pyridin-3-ylpropyl)urea
CID 110630952
3-(4-fluorophenyl)-N-(3-imidazo[1,5-a]pyridin-3-ylpropyl)propanamide
CID 110630927
2-(dimethylamino)-N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-2-phenylacetamide
CID 110630830
N-(2-imidazo[1,5-a]pyridin-3-ylethyl)-4-methyl-3-phenylpentanamide
CID 110313770
N-(3-imidazo[1,5-a]pyridin-3-ylpropyl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 110630950
N-(3-imidazo[1,5-a]pyridin-3-ylpropyl)-3-pyrrol-1-ylbenzamide
CID 110309684
3-(4-chlorophenyl)-2-methyl-N-[3-(4-sulfamoylphenyl)propyl]propanamide
CID 110310771
N-(3-imidazo[1,5-a]pyridin-3-ylpropyl)-4-methoxy-3-phenylbenzamide
CID 110630969
N-(3-imidazo[1,5-a]pyridin-3-ylpropyl)-1-phenylmethanesulfonamide
CID 110292198
N-(2-acetamidoethyl)-3-imidazo[1,5-a]pyridin-3-ylpropanamide
CID 110675061
3-(4-chlorophenyl)-N-[2-(2-methoxyphenyl)ethyl]-2-methylpropanamide
CID 110298815

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-N-(3-imidazo[1,5-a]pyridin-3-ylpropyl)-2-methylpropanamide?
The IUPAC name of 3-(4-chlorophenyl)-N-(3-imidazo[1,5-a]pyridin-3-ylpropyl)-2-methylpropanamide (CID 110309721) is 3-(4-chlorophenyl)-N-(3-imidazo[1,5-a]pyridin-3-ylpropyl)-2-methylpropanamide.
What is the SMILES notation for 3-(4-chlorophenyl)-N-(3-imidazo[1,5-a]pyridin-3-ylpropyl)-2-methylpropanamide?
The canonical SMILES for 3-(4-chlorophenyl)-N-(3-imidazo[1,5-a]pyridin-3-ylpropyl)-2-methylpropanamide is CC(Cc1ccc(Cl)cc1)C(=O)NCCCc1ncc2ccccn12.
What is the InChIKey of 3-(4-chlorophenyl)-N-(3-imidazo[1,5-a]pyridin-3-ylpropyl)-2-methylpropanamide?
The InChIKey is ADRSUZLPJKGMBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22ClN3O/c1-15(13-16-7-9-17(21)10-8-16)20(25)22-11-4-6-19-23-14-18-5-2-3-12-24(18)19/h2-3,5,7-10,12,14-15H,4,6,11,13H2,1H3,(H,22,25).
What are the key properties of 3-(4-chlorophenyl)-N-(3-imidazo[1,5-a]pyridin-3-ylpropyl)-2-methylpropanamide?
3-(4-chlorophenyl)-N-(3-imidazo[1,5-a]pyridin-3-ylpropyl)-2-methylpropanamide has a molecular weight of 355.87 g/mol, XLogP of 3.92, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-N-(3-imidazo[1,5-a]pyridin-3-ylpropyl)-2-methylpropanamide is sourced from PubChem (CID 110309721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).