3-imidazo[1,5-a]pyridin-3-yl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide

C21H25N5O — CID 110675075

IUPAC3-imidazo[1,5-a]pyridin-3-yl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide
SMILESCN1CCN(c2ccc(NC(=O)CCc3ncc4ccccn34)cc2)CC1
InChIInChI=1S/C21H25N5O/c1-24-12-14-25(15-13-24)18-7-5-17(6-8-18)23-21(27)10-9-20-22-16-19-4-2-3-11-26(19)20/h2-8,11,16H,9-10,12-15H2,1H3,(H,23,27)
InChIKeyJPDQNJKHELSDCC-UHFFFAOYSA-N
MW363.47 g/mol
LogP2.66
Rot. Bonds5

About 3-imidazo[1,5-a]pyridin-3-yl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide

3-imidazo[1,5-a]pyridin-3-yl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide (PubChem CID 110675075) has the molecular formula C21H25N5O and a molecular weight of 363.47 g/mol. Its IUPAC name is 3-imidazo[1,5-a]pyridin-3-yl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide.

Molecular Properties

Compound Name3-imidazo[1,5-a]pyridin-3-yl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide
PubChem CID110675075
Molecular FormulaC21H25N5O
Molecular Weight363.47 g/mol
Exact Mass363.21
IUPAC Name3-imidazo[1,5-a]pyridin-3-yl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide
SMILESCN1CCN(c2ccc(NC(=O)CCc3ncc4ccccn34)cc2)CC1
InChIInChI=1S/C21H25N5O/c1-24-12-14-25(15-13-24)18-7-5-17(6-8-18)23-21(27)10-9-20-22-16-19-4-2-3-11-26(19)20/h2-8,11,16H,9-10,12-15H2,1H3,(H,23,27)
InChIKeyJPDQNJKHELSDCC-UHFFFAOYSA-N
XLogP2.66
TPSA52.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.47
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

3-imidazo[1,5-a]pyridin-3-yl-N-[4-(4-methylpiperidin-1-yl)phenyl]propanamide
CID 110675073
N-[4-(4-methylpiperazin-1-yl)phenyl]-3-(1,3-oxazol-4-yl)propanamide
CID 110679110
3-imidazo[1,5-a]pyridin-3-yl-N-(2-morpholin-4-ylphenyl)propanamide
CID 110675074
N-(2-acetamidoethyl)-3-imidazo[1,5-a]pyridin-3-ylpropanamide
CID 110675061
2-hydroxy-N-[4-(4-methylpiperazin-1-yl)phenyl]acetamide
CID 83768240
4-amino-N-[4-(4-methylpiperazin-1-yl)phenyl]butanamide
CID 22692234
N-[4-(4-methylpiperazin-1-yl)phenyl]-4-oxo-4-pyridin-3-ylbutanamide
CID 110425405
N-[4-(4-methylpiperazin-1-yl)phenyl]-3-(3-phenylpropylamino)propanamide
CID 109030984
3-(2-chlorophenoxy)-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide
CID 108802305
3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide
CID 25408831
3-(4-acetamidoanilino)-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide
CID 109041251
N-[4-(4-methylpiperidin-1-yl)phenyl]-3-(1,3-oxazol-4-yl)propanamide
CID 110679108

Frequently Asked Questions

What is the IUPAC name of 3-imidazo[1,5-a]pyridin-3-yl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide?
The IUPAC name of 3-imidazo[1,5-a]pyridin-3-yl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide (CID 110675075) is 3-imidazo[1,5-a]pyridin-3-yl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide.
What is the SMILES notation for 3-imidazo[1,5-a]pyridin-3-yl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide?
The canonical SMILES for 3-imidazo[1,5-a]pyridin-3-yl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide is CN1CCN(c2ccc(NC(=O)CCc3ncc4ccccn34)cc2)CC1.
What is the InChIKey of 3-imidazo[1,5-a]pyridin-3-yl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide?
The InChIKey is JPDQNJKHELSDCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N5O/c1-24-12-14-25(15-13-24)18-7-5-17(6-8-18)23-21(27)10-9-20-22-16-19-4-2-3-11-26(19)20/h2-8,11,16H,9-10,12-15H2,1H3,(H,23,27).
What are the key properties of 3-imidazo[1,5-a]pyridin-3-yl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide?
3-imidazo[1,5-a]pyridin-3-yl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide has a molecular weight of 363.47 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-imidazo[1,5-a]pyridin-3-yl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide is sourced from PubChem (CID 110675075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).