N'-(1-benzylpyrazole-4-carbonyl)-2-methylimidazo[1,2-a]pyridine-3-carbohydrazide

C20H18N6O2 — CID 24541606

IUPACN'-(1-benzylpyrazole-4-carbonyl)-2-methylimidazo[1,2-a]pyridine-3-carbohydrazide
SMILESCc1nc2ccccn2c1C(=O)NNC(=O)c1cnn(Cc2ccccc2)c1
InChIInChI=1S/C20H18N6O2/c1-14-18(26-10-6-5-9-17(26)22-14)20(28)24-23-19(27)16-11-21-25(13-16)12-15-7-3-2-4-8-15/h2-11,13H,12H2,1H3,(H,23,27)(H,24,28)
InChIKeyTXLYJUQKTBVSLT-UHFFFAOYSA-N
MW374.40 g/mol
LogP1.96
Rot. Bonds4

About N'-(1-benzylpyrazole-4-carbonyl)-2-methylimidazo[1,2-a]pyridine-3-carbohydrazide

N'-(1-benzylpyrazole-4-carbonyl)-2-methylimidazo[1,2-a]pyridine-3-carbohydrazide (PubChem CID 24541606) has the molecular formula C20H18N6O2 and a molecular weight of 374.40 g/mol. Its IUPAC name is N'-(1-benzylpyrazole-4-carbonyl)-2-methylimidazo[1,2-a]pyridine-3-carbohydrazide.

Molecular Properties

Compound NameN'-(1-benzylpyrazole-4-carbonyl)-2-methylimidazo[1,2-a]pyridine-3-carbohydrazide
PubChem CID24541606
Molecular FormulaC20H18N6O2
Molecular Weight374.40 g/mol
Exact Mass374.15
IUPAC NameN'-(1-benzylpyrazole-4-carbonyl)-2-methylimidazo[1,2-a]pyridine-3-carbohydrazide
SMILESCc1nc2ccccn2c1C(=O)NNC(=O)c1cnn(Cc2ccccc2)c1
InChIInChI=1S/C20H18N6O2/c1-14-18(26-10-6-5-9-17(26)22-14)20(28)24-23-19(27)16-11-21-25(13-16)12-15-7-3-2-4-8-15/h2-11,13H,12H2,1H3,(H,23,27)(H,24,28)
InChIKeyTXLYJUQKTBVSLT-UHFFFAOYSA-N
XLogP1.96
TPSA93.32 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.40
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-(1-benzylpyrazole-4-carbonyl)-2-methylimidazo[1,2-a]pyridine-3-carbohydrazide?
The IUPAC name of N'-(1-benzylpyrazole-4-carbonyl)-2-methylimidazo[1,2-a]pyridine-3-carbohydrazide (CID 24541606) is N'-(1-benzylpyrazole-4-carbonyl)-2-methylimidazo[1,2-a]pyridine-3-carbohydrazide.
What is the SMILES notation for N'-(1-benzylpyrazole-4-carbonyl)-2-methylimidazo[1,2-a]pyridine-3-carbohydrazide?
The canonical SMILES for N'-(1-benzylpyrazole-4-carbonyl)-2-methylimidazo[1,2-a]pyridine-3-carbohydrazide is Cc1nc2ccccn2c1C(=O)NNC(=O)c1cnn(Cc2ccccc2)c1.
What is the InChIKey of N'-(1-benzylpyrazole-4-carbonyl)-2-methylimidazo[1,2-a]pyridine-3-carbohydrazide?
The InChIKey is TXLYJUQKTBVSLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N6O2/c1-14-18(26-10-6-5-9-17(26)22-14)20(28)24-23-19(27)16-11-21-25(13-16)12-15-7-3-2-4-8-15/h2-11,13H,12H2,1H3,(H,23,27)(H,24,28).
What are the key properties of N'-(1-benzylpyrazole-4-carbonyl)-2-methylimidazo[1,2-a]pyridine-3-carbohydrazide?
N'-(1-benzylpyrazole-4-carbonyl)-2-methylimidazo[1,2-a]pyridine-3-carbohydrazide has a molecular weight of 374.40 g/mol, XLogP of 1.96, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1-benzylpyrazole-4-carbonyl)-2-methylimidazo[1,2-a]pyridine-3-carbohydrazide is sourced from PubChem (CID 24541606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).