(6-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-benzylpyrazolo[3,4-b]pyridine-5-carboxylate

C23H19N5O2 — CID 167866574

IUPAC(6-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-benzylpyrazolo[3,4-b]pyridine-5-carboxylate
SMILESCc1ccc2nc(COC(=O)c3cnc4c(cnn4Cc4ccccc4)c3)cn2c1
InChIInChI=1S/C23H19N5O2/c1-16-7-8-21-26-20(14-27(21)12-16)15-30-23(29)19-9-18-11-25-28(22(18)24-10-19)13-17-5-3-2-4-6-17/h2-12,14H,13,15H2,1H3
InChIKeyWIFUZVVWEQJKBW-UHFFFAOYSA-N
MW397.44 g/mol
LogP3.79
Rot. Bonds5

About (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-benzylpyrazolo[3,4-b]pyridine-5-carboxylate

(6-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-benzylpyrazolo[3,4-b]pyridine-5-carboxylate (PubChem CID 167866574) has the molecular formula C23H19N5O2 and a molecular weight of 397.44 g/mol. Its IUPAC name is (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-benzylpyrazolo[3,4-b]pyridine-5-carboxylate.

Molecular Properties

Compound Name(6-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-benzylpyrazolo[3,4-b]pyridine-5-carboxylate
PubChem CID167866574
Molecular FormulaC23H19N5O2
Molecular Weight397.44 g/mol
Exact Mass397.15
IUPAC Name(6-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-benzylpyrazolo[3,4-b]pyridine-5-carboxylate
SMILESCc1ccc2nc(COC(=O)c3cnc4c(cnn4Cc4ccccc4)c3)cn2c1
InChIInChI=1S/C23H19N5O2/c1-16-7-8-21-26-20(14-27(21)12-16)15-30-23(29)19-9-18-11-25-28(22(18)24-10-19)13-17-5-3-2-4-6-17/h2-12,14H,13,15H2,1H3
InChIKeyWIFUZVVWEQJKBW-UHFFFAOYSA-N
XLogP3.79
TPSA74.31 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.44
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-benzylpyrazolo[3,4-b]pyridine-5-carboxylate with MolForge

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Related Compounds

(3-methyl-1,2-oxazol-5-yl)methyl 1-benzylpyrazolo[3,4-b]pyridine-5-carboxylate
CID 31198228
(6-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-[(2-chlorophenyl)methyl]pyrazole-4-carboxylate
CID 38299688
1-benzyl-N-(3-methylbutan-2-yl)pyrazolo[3,4-b]pyridine-5-carboxamide
CID 43042463
1-benzyl-N-(3-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide
CID 24624200
1-benzyl-N,N-dipropylpyrazolo[3,4-b]pyridine-5-carboxamide
CID 78839414
1-benzyl-N-(2-ethoxyethyl)pyrazolo[3,4-b]pyridine-5-carboxamide
CID 87020146
1-benzyl-N-methoxy-N-methylpyrazolo[3,4-b]pyridine-5-carboxamide
CID 24688178
(6-methylimidazo[1,2-a]pyridin-2-yl)methyl 3-methoxybenzoate
CID 18099535
1-benzyl-N-(1-methylpyrazol-4-yl)pyrazolo[3,4-b]pyridine-5-carboxamide
CID 32607487
(6-methylimidazo[1,2-a]pyridin-2-yl)methyl 3-chloro-4,5-dimethoxybenzoate
CID 18099823
1-benzyl-N-(1-hydroxybutan-2-yl)pyrazolo[3,4-b]pyridine-5-carboxamide
CID 110886300
2-hydroxyethyl 1-[(4-methoxyphenyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxylate
CID 141389743

Frequently Asked Questions

What is the IUPAC name of (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-benzylpyrazolo[3,4-b]pyridine-5-carboxylate?
The IUPAC name of (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-benzylpyrazolo[3,4-b]pyridine-5-carboxylate (CID 167866574) is (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-benzylpyrazolo[3,4-b]pyridine-5-carboxylate.
What is the SMILES notation for (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-benzylpyrazolo[3,4-b]pyridine-5-carboxylate?
The canonical SMILES for (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-benzylpyrazolo[3,4-b]pyridine-5-carboxylate is Cc1ccc2nc(COC(=O)c3cnc4c(cnn4Cc4ccccc4)c3)cn2c1.
What is the InChIKey of (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-benzylpyrazolo[3,4-b]pyridine-5-carboxylate?
The InChIKey is WIFUZVVWEQJKBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N5O2/c1-16-7-8-21-26-20(14-27(21)12-16)15-30-23(29)19-9-18-11-25-28(22(18)24-10-19)13-17-5-3-2-4-6-17/h2-12,14H,13,15H2,1H3.
What are the key properties of (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-benzylpyrazolo[3,4-b]pyridine-5-carboxylate?
(6-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-benzylpyrazolo[3,4-b]pyridine-5-carboxylate has a molecular weight of 397.44 g/mol, XLogP of 3.79, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methylimidazo[1,2-a]pyridin-2-yl)methyl 1-benzylpyrazolo[3,4-b]pyridine-5-carboxylate is sourced from PubChem (CID 167866574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).