2-cyclopropyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]quinoline-4-carbohydrazide

C20H21N5O2 — CID 9424886

IUPAC2-cyclopropyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]quinoline-4-carbohydrazide
SMILESCc1cc(C)n(CC(=O)NNC(=O)c2cc(C3CC3)nc3ccccc23)n1
InChIInChI=1S/C20H21N5O2/c1-12-9-13(2)25(24-12)11-19(26)22-23-20(27)16-10-18(14-7-8-14)21-17-6-4-3-5-15(16)17/h3-6,9-10,14H,7-8,11H2,1-2H3,(H,22,26)(H,23,27)
InChIKeyDZELQNZBKYJKCR-UHFFFAOYSA-N
MW363.42 g/mol
LogP2.39
Rot. Bonds4

About 2-cyclopropyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]quinoline-4-carbohydrazide

2-cyclopropyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]quinoline-4-carbohydrazide (PubChem CID 9424886) has the molecular formula C20H21N5O2 and a molecular weight of 363.42 g/mol. Its IUPAC name is 2-cyclopropyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]quinoline-4-carbohydrazide.

Molecular Properties

Compound Name2-cyclopropyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]quinoline-4-carbohydrazide
PubChem CID9424886
Molecular FormulaC20H21N5O2
Molecular Weight363.42 g/mol
Exact Mass363.17
IUPAC Name2-cyclopropyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]quinoline-4-carbohydrazide
SMILESCc1cc(C)n(CC(=O)NNC(=O)c2cc(C3CC3)nc3ccccc23)n1
InChIInChI=1S/C20H21N5O2/c1-12-9-13(2)25(24-12)11-19(26)22-23-20(27)16-10-18(14-7-8-14)21-17-6-4-3-5-15(16)17/h3-6,9-10,14H,7-8,11H2,1-2H3,(H,22,26)(H,23,27)
InChIKeyDZELQNZBKYJKCR-UHFFFAOYSA-N
XLogP2.39
TPSA88.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.42
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-cyclopropyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]quinoline-4-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-cyclopropyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carbohydrazide
CID 134025243
N'-(4-chlorobenzoyl)-2-cyclopropylquinoline-4-carbohydrazide
CID 9206846
N-(1-amino-2-methylpropan-2-yl)-2-cyclopropylquinoline-4-carboxamide;dihydrochloride
CID 119522890
N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]-2-(4-oxoquinazolin-3-yl)acetohydrazide
CID 7969443
2-cyclopropyl-N-methylsulfonylquinoline-4-carboxamide
CID 146154924
N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]-2,4-dimethylbenzohydrazide
CID 26614017
2-cyclopentylquinoline-4-carbohydrazide
CID 5270704
N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]-3-ethyl-4-oxophthalazine-1-carbohydrazide
CID 7969430
N'-[2-(1,3-benzothiazol-2-ylmethoxy)acetyl]-2-(3,5-dimethylpyrazol-1-yl)acetohydrazide
CID 9425052
N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]-4-ethylbenzohydrazide
CID 26614008
1-benzyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]-3-phenylpyrazole-4-carbohydrazide
CID 29218613
2-cyclopropyl-N'-[3-(4-fluorophenyl)imidazole-4-carbonyl]quinoline-4-carbohydrazide
CID 9158137

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]quinoline-4-carbohydrazide?
The IUPAC name of 2-cyclopropyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]quinoline-4-carbohydrazide (CID 9424886) is 2-cyclopropyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]quinoline-4-carbohydrazide.
What is the SMILES notation for 2-cyclopropyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]quinoline-4-carbohydrazide?
The canonical SMILES for 2-cyclopropyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]quinoline-4-carbohydrazide is Cc1cc(C)n(CC(=O)NNC(=O)c2cc(C3CC3)nc3ccccc23)n1.
What is the InChIKey of 2-cyclopropyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]quinoline-4-carbohydrazide?
The InChIKey is DZELQNZBKYJKCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N5O2/c1-12-9-13(2)25(24-12)11-19(26)22-23-20(27)16-10-18(14-7-8-14)21-17-6-4-3-5-15(16)17/h3-6,9-10,14H,7-8,11H2,1-2H3,(H,22,26)(H,23,27).
What are the key properties of 2-cyclopropyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]quinoline-4-carbohydrazide?
2-cyclopropyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]quinoline-4-carbohydrazide has a molecular weight of 363.42 g/mol, XLogP of 2.39, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]quinoline-4-carbohydrazide is sourced from PubChem (CID 9424886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).