N'-(4-methoxy-1-phenylpyrazole-3-carbonyl)pyridine-3-carbohydrazide

C17H15N5O3 — CID 26721272

IUPACN'-(4-methoxy-1-phenylpyrazole-3-carbonyl)pyridine-3-carbohydrazide
SMILESCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1cccnc1
InChIInChI=1S/C17H15N5O3/c1-25-14-11-22(13-7-3-2-4-8-13)21-15(14)17(24)20-19-16(23)12-6-5-9-18-10-12/h2-11H,1H3,(H,19,23)(H,20,24)
InChIKeyDPBIQXDJYPVXJR-UHFFFAOYSA-N
MW337.34 g/mol
LogP1.35
Rot. Bonds4

About N'-(4-methoxy-1-phenylpyrazole-3-carbonyl)pyridine-3-carbohydrazide

N'-(4-methoxy-1-phenylpyrazole-3-carbonyl)pyridine-3-carbohydrazide (PubChem CID 26721272) has the molecular formula C17H15N5O3 and a molecular weight of 337.34 g/mol. Its IUPAC name is N'-(4-methoxy-1-phenylpyrazole-3-carbonyl)pyridine-3-carbohydrazide.

Molecular Properties

Compound NameN'-(4-methoxy-1-phenylpyrazole-3-carbonyl)pyridine-3-carbohydrazide
PubChem CID26721272
Molecular FormulaC17H15N5O3
Molecular Weight337.34 g/mol
Exact Mass337.12
IUPAC NameN'-(4-methoxy-1-phenylpyrazole-3-carbonyl)pyridine-3-carbohydrazide
SMILESCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1cccnc1
InChIInChI=1S/C17H15N5O3/c1-25-14-11-22(13-7-3-2-4-8-13)21-15(14)17(24)20-19-16(23)12-6-5-9-18-10-12/h2-11H,1H3,(H,19,23)(H,20,24)
InChIKeyDPBIQXDJYPVXJR-UHFFFAOYSA-N
XLogP1.35
TPSA98.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.34
LogP ≤ 51.35
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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Related Compounds

4-methoxy-1-phenyl-N-pyridin-4-ylpyrazole-3-carboxamide
CID 17440224
phenacyl 4-methoxy-1-phenylpyrazole-3-carboxylate
CID 7992049
N'-(4-methoxy-1-phenylpyrazole-3-carbonyl)-4-oxo-3H-phthalazine-1-carbohydrazide
CID 24514493
4-methoxy-1-phenyl-N-pyridin-2-ylpyrazole-3-carboxamide
CID 24538158
N'-[3-(4-chlorophenyl)-1-phenylpyrazole-4-carbonyl]pyridine-3-carbohydrazide
CID 29205060
3-acetyl-5-methoxy-1-pyridin-3-ylpyridazin-4-one
CID 59436177
4-methoxy-N-[(2S)-5-methylhexan-2-yl]-1-phenylpyrazole-3-carboxamide
CID 51862939
N-(3,4-dimethylphenyl)-4-methoxy-1-phenylpyrazole-3-carboxamide
CID 7992464
4-methoxy-1-phenyl-N-(2-phenylphenyl)pyrazole-3-carboxamide
CID 27844736
5-[(4-methoxy-1-phenylpyrazole-3-carbonyl)amino]pentanoic acid
CID 119234819
4-methoxy-N-[2-(methylamino)propyl]-1-phenylpyrazole-3-carboxamide;hydrochloride
CID 120832216
dimethyl 5-(4-methoxy-1-phenylpyrazole-3-carbonyl)oxybenzene-1,3-dicarboxylate
CID 9456471

Frequently Asked Questions

What is the IUPAC name of N'-(4-methoxy-1-phenylpyrazole-3-carbonyl)pyridine-3-carbohydrazide?
The IUPAC name of N'-(4-methoxy-1-phenylpyrazole-3-carbonyl)pyridine-3-carbohydrazide (CID 26721272) is N'-(4-methoxy-1-phenylpyrazole-3-carbonyl)pyridine-3-carbohydrazide.
What is the SMILES notation for N'-(4-methoxy-1-phenylpyrazole-3-carbonyl)pyridine-3-carbohydrazide?
The canonical SMILES for N'-(4-methoxy-1-phenylpyrazole-3-carbonyl)pyridine-3-carbohydrazide is COc1cn(-c2ccccc2)nc1C(=O)NNC(=O)c1cccnc1.
What is the InChIKey of N'-(4-methoxy-1-phenylpyrazole-3-carbonyl)pyridine-3-carbohydrazide?
The InChIKey is DPBIQXDJYPVXJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O3/c1-25-14-11-22(13-7-3-2-4-8-13)21-15(14)17(24)20-19-16(23)12-6-5-9-18-10-12/h2-11H,1H3,(H,19,23)(H,20,24).
What are the key properties of N'-(4-methoxy-1-phenylpyrazole-3-carbonyl)pyridine-3-carbohydrazide?
N'-(4-methoxy-1-phenylpyrazole-3-carbonyl)pyridine-3-carbohydrazide has a molecular weight of 337.34 g/mol, XLogP of 1.35, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-methoxy-1-phenylpyrazole-3-carbonyl)pyridine-3-carbohydrazide is sourced from PubChem (CID 26721272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).