2-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[1,2-a]pyridine

C17H21N5 — CID 56780480

IUPAC2-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[1,2-a]pyridine
SMILESCc1cnn(CC2CCCN2Cc2cn3ccccc3n2)c1
InChIInChI=1S/C17H21N5/c1-14-9-18-22(10-14)13-16-5-4-8-20(16)11-15-12-21-7-3-2-6-17(21)19-15/h2-3,6-7,9-10,12,16H,4-5,8,11,13H2,1H3
InChIKeyPGDHPIMOZYMZKP-UHFFFAOYSA-N
MW295.39 g/mol
LogP2.50
Rot. Bonds4

About 2-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[1,2-a]pyridine

2-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[1,2-a]pyridine (PubChem CID 56780480) has the molecular formula C17H21N5 and a molecular weight of 295.39 g/mol. Its IUPAC name is 2-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[1,2-a]pyridine
PubChem CID56780480
Molecular FormulaC17H21N5
Molecular Weight295.39 g/mol
Exact Mass295.18
IUPAC Name2-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[1,2-a]pyridine
SMILESCc1cnn(CC2CCCN2Cc2cn3ccccc3n2)c1
InChIInChI=1S/C17H21N5/c1-14-9-18-22(10-14)13-16-5-4-8-20(16)11-15-12-21-7-3-2-6-17(21)19-15/h2-3,6-7,9-10,12,16H,4-5,8,11,13H2,1H3
InChIKeyPGDHPIMOZYMZKP-UHFFFAOYSA-N
XLogP2.50
TPSA38.36 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 2-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[1,2-a]pyridine (CID 56780480) is 2-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 2-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[1,2-a]pyridine is Cc1cnn(CC2CCCN2Cc2cn3ccccc3n2)c1.
What is the InChIKey of 2-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[1,2-a]pyridine?
The InChIKey is PGDHPIMOZYMZKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5/c1-14-9-18-22(10-14)13-16-5-4-8-20(16)11-15-12-21-7-3-2-6-17(21)19-15/h2-3,6-7,9-10,12,16H,4-5,8,11,13H2,1H3.
What are the key properties of 2-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[1,2-a]pyridine?
2-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[1,2-a]pyridine has a molecular weight of 295.39 g/mol, XLogP of 2.50, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 56780480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).