6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one

C17H18N8O — CID 137267913

IUPAC6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one
SMILESO=c1[nH]c(N2CCN(Cc3cn4ccccc4n3)CC2)nc2[nH]ncc12
InChIInChI=1S/C17H18N8O/c26-16-13-9-18-22-15(13)20-17(21-16)24-7-5-23(6-8-24)10-12-11-25-4-2-1-3-14(25)19-12/h1-4,9,11H,5-8,10H2,(H2,18,20,21,22,26)
InChIKeyUGGFOCQWQMKQFV-UHFFFAOYSA-N
MW350.39 g/mol
LogP0.62
Rot. Bonds3

About 6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one

6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one (PubChem CID 137267913) has the molecular formula C17H18N8O and a molecular weight of 350.39 g/mol. Its IUPAC name is 6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one.

Molecular Properties

Compound Name6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one
PubChem CID137267913
Molecular FormulaC17H18N8O
Molecular Weight350.39 g/mol
Exact Mass350.16
IUPAC Name6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one
SMILESO=c1[nH]c(N2CCN(Cc3cn4ccccc4n3)CC2)nc2[nH]ncc12
InChIInChI=1S/C17H18N8O/c26-16-13-9-18-22-15(13)20-17(21-16)24-7-5-23(6-8-24)10-12-11-25-4-2-1-3-14(25)19-12/h1-4,9,11H,5-8,10H2,(H2,18,20,21,22,26)
InChIKeyUGGFOCQWQMKQFV-UHFFFAOYSA-N
XLogP0.62
TPSA98.21 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.39
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 4701931
2-[[4-(3,4-dichlorophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 11516033
2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 45366493
2-[[4-(5-methylpyrimidin-4-yl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 163346240
5-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]sulfonyl-1,3-dihydrobenzimidazol-2-one
CID 146084118
2-[[4-[(3-chlorophenyl)methyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 6464477
2-[[4-(4-methylsulfonyl-2-nitrophenyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 18101778
N-ethyl-4-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-6-methylpyrimidin-2-amine
CID 155800877
6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-N-pentan-3-ylpyridine-3-sulfonamide
CID 55816285
3-[[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]methyl]-1,2-benzoxazole
CID 171998247
2-amino-1-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-2-methylpropan-1-one;dihydrochloride
CID 119837375
2-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 22197062

Frequently Asked Questions

What is the IUPAC name of 6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one?
The IUPAC name of 6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one (CID 137267913) is 6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one.
What is the SMILES notation for 6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one?
The canonical SMILES for 6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one is O=c1[nH]c(N2CCN(Cc3cn4ccccc4n3)CC2)nc2[nH]ncc12.
What is the InChIKey of 6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one?
The InChIKey is UGGFOCQWQMKQFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N8O/c26-16-13-9-18-22-15(13)20-17(21-16)24-7-5-23(6-8-24)10-12-11-25-4-2-1-3-14(25)19-12/h1-4,9,11H,5-8,10H2,(H2,18,20,21,22,26).
What are the key properties of 6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one?
6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one has a molecular weight of 350.39 g/mol, XLogP of 0.62, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-1,5-dihydropyrazolo[5,4-d]pyrimidin-4-one is sourced from PubChem (CID 137267913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).