1-ethyl-6-phenyl-N'-(1H-pyrrole-2-carbonyl)pyrazolo[5,4-b]pyridine-4-carbohydrazide

C20H18N6O2 — CID 78835097

IUPAC1-ethyl-6-phenyl-N'-(1H-pyrrole-2-carbonyl)pyrazolo[5,4-b]pyridine-4-carbohydrazide
SMILESCCn1ncc2c(C(=O)NNC(=O)c3ccc[nH]3)cc(-c3ccccc3)nc21
InChIInChI=1S/C20H18N6O2/c1-2-26-18-15(12-22-26)14(11-17(23-18)13-7-4-3-5-8-13)19(27)24-25-20(28)16-9-6-10-21-16/h3-12,21H,2H2,1H3,(H,24,27)(H,25,28)
InChIKeyFCDGNWVOHYOMJK-UHFFFAOYSA-N
MW374.40 g/mol
LogP2.52
Rot. Bonds4

About 1-ethyl-6-phenyl-N'-(1H-pyrrole-2-carbonyl)pyrazolo[5,4-b]pyridine-4-carbohydrazide

1-ethyl-6-phenyl-N'-(1H-pyrrole-2-carbonyl)pyrazolo[5,4-b]pyridine-4-carbohydrazide (PubChem CID 78835097) has the molecular formula C20H18N6O2 and a molecular weight of 374.40 g/mol. Its IUPAC name is 1-ethyl-6-phenyl-N'-(1H-pyrrole-2-carbonyl)pyrazolo[5,4-b]pyridine-4-carbohydrazide.

Molecular Properties

Compound Name1-ethyl-6-phenyl-N'-(1H-pyrrole-2-carbonyl)pyrazolo[5,4-b]pyridine-4-carbohydrazide
PubChem CID78835097
Molecular FormulaC20H18N6O2
Molecular Weight374.40 g/mol
Exact Mass374.15
IUPAC Name1-ethyl-6-phenyl-N'-(1H-pyrrole-2-carbonyl)pyrazolo[5,4-b]pyridine-4-carbohydrazide
SMILESCCn1ncc2c(C(=O)NNC(=O)c3ccc[nH]3)cc(-c3ccccc3)nc21
InChIInChI=1S/C20H18N6O2/c1-2-26-18-15(12-22-26)14(11-17(23-18)13-7-4-3-5-8-13)19(27)24-25-20(28)16-9-6-10-21-16/h3-12,21H,2H2,1H3,(H,24,27)(H,25,28)
InChIKeyFCDGNWVOHYOMJK-UHFFFAOYSA-N
XLogP2.52
TPSA104.70 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.40
LogP ≤ 52.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(3-aminopropyl)-1-ethyl-6-phenylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 119405435
N'-(4-bromo-1-methylpyrrole-2-carbonyl)-1-ethyl-6-phenylpyrazolo[5,4-b]pyridine-4-carbohydrazide
CID 43041655
1-ethyl-N-[2-(4-fluorophenyl)ethyl]-6-phenylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 55486953
1-ethyl-6-phenyl-N-(2,4,6-trimethylphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 25400422
methyl 6-[(1-ethyl-6-phenylpyrazolo[5,4-b]pyridine-4-carbonyl)amino]hexanoate
CID 30125131
N-(2,4-dimethylphenyl)-1-ethyl-6-phenylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 44823079
1-ethyl-6-phenyl-N-piperidin-1-ylsulfonylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 60565138
N-(4-cyanophenyl)-1-ethyl-6-phenylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 16590998
N-(1-benzylpyrazol-4-yl)-1-ethyl-6-phenylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 55982114
1-ethyl-6-phenyl-N-(2,4,6-trimethyl-3-pyridinyl)pyrazolo[5,4-b]pyridine-4-carboxamide
CID 78859789
2-[(1-ethyl-6-phenylpyrazolo[5,4-b]pyridine-4-carbonyl)amino]-3-methoxy-2-methylpropanoic acid
CID 120531682
1-ethyl-N-(1-ethyl-6-oxo-3-pyridinyl)-6-phenylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 60556984

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-6-phenyl-N'-(1H-pyrrole-2-carbonyl)pyrazolo[5,4-b]pyridine-4-carbohydrazide?
The IUPAC name of 1-ethyl-6-phenyl-N'-(1H-pyrrole-2-carbonyl)pyrazolo[5,4-b]pyridine-4-carbohydrazide (CID 78835097) is 1-ethyl-6-phenyl-N'-(1H-pyrrole-2-carbonyl)pyrazolo[5,4-b]pyridine-4-carbohydrazide.
What is the SMILES notation for 1-ethyl-6-phenyl-N'-(1H-pyrrole-2-carbonyl)pyrazolo[5,4-b]pyridine-4-carbohydrazide?
The canonical SMILES for 1-ethyl-6-phenyl-N'-(1H-pyrrole-2-carbonyl)pyrazolo[5,4-b]pyridine-4-carbohydrazide is CCn1ncc2c(C(=O)NNC(=O)c3ccc[nH]3)cc(-c3ccccc3)nc21.
What is the InChIKey of 1-ethyl-6-phenyl-N'-(1H-pyrrole-2-carbonyl)pyrazolo[5,4-b]pyridine-4-carbohydrazide?
The InChIKey is FCDGNWVOHYOMJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N6O2/c1-2-26-18-15(12-22-26)14(11-17(23-18)13-7-4-3-5-8-13)19(27)24-25-20(28)16-9-6-10-21-16/h3-12,21H,2H2,1H3,(H,24,27)(H,25,28).
What are the key properties of 1-ethyl-6-phenyl-N'-(1H-pyrrole-2-carbonyl)pyrazolo[5,4-b]pyridine-4-carbohydrazide?
1-ethyl-6-phenyl-N'-(1H-pyrrole-2-carbonyl)pyrazolo[5,4-b]pyridine-4-carbohydrazide has a molecular weight of 374.40 g/mol, XLogP of 2.52, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-6-phenyl-N'-(1H-pyrrole-2-carbonyl)pyrazolo[5,4-b]pyridine-4-carbohydrazide is sourced from PubChem (CID 78835097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).