6-methyl-N'-[5-oxo-1-(1-phenylethyl)pyrrolidine-3-carbonyl]pyridine-2-carbohydrazide

C20H22N4O3 — CID 166221985

IUPAC6-methyl-N'-[5-oxo-1-(1-phenylethyl)pyrrolidine-3-carbonyl]pyridine-2-carbohydrazide
SMILESCc1cccc(C(=O)NNC(=O)C2CC(=O)N(C(C)c3ccccc3)C2)n1
InChIInChI=1S/C20H22N4O3/c1-13-7-6-10-17(21-13)20(27)23-22-19(26)16-11-18(25)24(12-16)14(2)15-8-4-3-5-9-15/h3-10,14,16H,11-12H2,1-2H3,(H,22,26)(H,23,27)
InChIKeyHUNWEKQWQFOKSZ-UHFFFAOYSA-N
MW366.42 g/mol
LogP1.76
Rot. Bonds4

About 6-methyl-N'-[5-oxo-1-(1-phenylethyl)pyrrolidine-3-carbonyl]pyridine-2-carbohydrazide

6-methyl-N'-[5-oxo-1-(1-phenylethyl)pyrrolidine-3-carbonyl]pyridine-2-carbohydrazide (PubChem CID 166221985) has the molecular formula C20H22N4O3 and a molecular weight of 366.42 g/mol. Its IUPAC name is 6-methyl-N'-[5-oxo-1-(1-phenylethyl)pyrrolidine-3-carbonyl]pyridine-2-carbohydrazide.

Molecular Properties

Compound Name6-methyl-N'-[5-oxo-1-(1-phenylethyl)pyrrolidine-3-carbonyl]pyridine-2-carbohydrazide
PubChem CID166221985
Molecular FormulaC20H22N4O3
Molecular Weight366.42 g/mol
Exact Mass366.17
IUPAC Name6-methyl-N'-[5-oxo-1-(1-phenylethyl)pyrrolidine-3-carbonyl]pyridine-2-carbohydrazide
SMILESCc1cccc(C(=O)NNC(=O)C2CC(=O)N(C(C)c3ccccc3)C2)n1
InChIInChI=1S/C20H22N4O3/c1-13-7-6-10-17(21-13)20(27)23-22-19(26)16-11-18(25)24(12-16)14(2)15-8-4-3-5-9-15/h3-10,14,16H,11-12H2,1-2H3,(H,22,26)(H,23,27)
InChIKeyHUNWEKQWQFOKSZ-UHFFFAOYSA-N
XLogP1.76
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 6-methyl-N'-[5-oxo-1-(1-phenylethyl)pyrrolidine-3-carbonyl]pyridine-2-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

N'-(5-methylfuran-2-carbonyl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carbohydrazide
CID 166231533
(3R)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-5-oxo-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxamide
CID 7394287
(3S)-N-(3-methylphenyl)-5-oxo-1-[(1S)-1-phenylethyl]pyrrolidine-3-carboxamide
CID 9004758
(3R)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-5-oxo-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxamide
CID 94172181
(4R)-4-(cyclobutanecarbonyl)-1-[(1R)-1-phenylethyl]pyrrolidin-2-one
CID 21087447
(3R)-N-(4-acetamidophenyl)-5-oxo-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxamide
CID 9004802
(3R)-5-oxo-1-[(1R)-1-phenylethyl]-N-pyridin-2-ylpyrrolidine-3-carboxamide
CID 94480588
N-(5-methyl-1,2-oxazol-3-yl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide
CID 3160086
6-oxo-N-[2-[[5-oxo-1-(1-phenylethyl)pyrrolidine-3-carbonyl]amino]ethyl]-1H-pyridazine-3-carboxamide
CID 108540908
N-[2-(2-methylpropanoylamino)ethyl]-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide
CID 108540941
4-[[(3R)-5-oxo-1-[(1S)-1-phenylethyl]pyrrolidine-3-carbonyl]amino]benzoate
CID 9004705
N-(2-aminoethyl)-5-oxo-1-(1-phenylethyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119381978

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N'-[5-oxo-1-(1-phenylethyl)pyrrolidine-3-carbonyl]pyridine-2-carbohydrazide?
The IUPAC name of 6-methyl-N'-[5-oxo-1-(1-phenylethyl)pyrrolidine-3-carbonyl]pyridine-2-carbohydrazide (CID 166221985) is 6-methyl-N'-[5-oxo-1-(1-phenylethyl)pyrrolidine-3-carbonyl]pyridine-2-carbohydrazide.
What is the SMILES notation for 6-methyl-N'-[5-oxo-1-(1-phenylethyl)pyrrolidine-3-carbonyl]pyridine-2-carbohydrazide?
The canonical SMILES for 6-methyl-N'-[5-oxo-1-(1-phenylethyl)pyrrolidine-3-carbonyl]pyridine-2-carbohydrazide is Cc1cccc(C(=O)NNC(=O)C2CC(=O)N(C(C)c3ccccc3)C2)n1.
What is the InChIKey of 6-methyl-N'-[5-oxo-1-(1-phenylethyl)pyrrolidine-3-carbonyl]pyridine-2-carbohydrazide?
The InChIKey is HUNWEKQWQFOKSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O3/c1-13-7-6-10-17(21-13)20(27)23-22-19(26)16-11-18(25)24(12-16)14(2)15-8-4-3-5-9-15/h3-10,14,16H,11-12H2,1-2H3,(H,22,26)(H,23,27).
What are the key properties of 6-methyl-N'-[5-oxo-1-(1-phenylethyl)pyrrolidine-3-carbonyl]pyridine-2-carbohydrazide?
6-methyl-N'-[5-oxo-1-(1-phenylethyl)pyrrolidine-3-carbonyl]pyridine-2-carbohydrazide has a molecular weight of 366.42 g/mol, XLogP of 1.76, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N'-[5-oxo-1-(1-phenylethyl)pyrrolidine-3-carbonyl]pyridine-2-carbohydrazide is sourced from PubChem (CID 166221985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).