N'-(4-methylpentan-2-yl)pyridine-4-carbohydrazide

C12H19N3O — CID 27512

IUPACN'-(4-methylpentan-2-yl)pyridine-4-carbohydrazide
SMILESCC(C)CC(C)NNC(=O)c1ccncc1
InChIInChI=1S/C12H19N3O/c1-9(2)8-10(3)14-15-12(16)11-4-6-13-7-5-11/h4-7,9-10,14H,8H2,1-3H3,(H,15,16)
InChIKeyZGCUMYSTJDFOCK-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.75
Rot. Bonds5

About N'-(4-methylpentan-2-yl)pyridine-4-carbohydrazide

N'-(4-methylpentan-2-yl)pyridine-4-carbohydrazide (PubChem CID 27512) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N'-(4-methylpentan-2-yl)pyridine-4-carbohydrazide.

Molecular Properties

Compound NameN'-(4-methylpentan-2-yl)pyridine-4-carbohydrazide
PubChem CID27512
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN'-(4-methylpentan-2-yl)pyridine-4-carbohydrazide
SMILESCC(C)CC(C)NNC(=O)c1ccncc1
InChIInChI=1S/C12H19N3O/c1-9(2)8-10(3)14-15-12(16)11-4-6-13-7-5-11/h4-7,9-10,14H,8H2,1-3H3,(H,15,16)
InChIKeyZGCUMYSTJDFOCK-UHFFFAOYSA-N
XLogP1.75
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N'-(4-methylpentan-2-yl)pyridine-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

N'-[(2R)-4-methylpentan-2-yl]benzohydrazide
CID 134953051
N'-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-4-carbohydrazide
CID 95561922
N-(5-methylhexan-2-yl)pyridine-4-carboxamide
CID 42890124
4-methyl-2-(pyridine-4-carbonylamino)pentanoic acid
CID 16777118
N'-[(2R)-2-aminopropanoyl]pyridine-4-carbohydrazide
CID 24838770
N-(4-chlorobutan-2-yl)pyridine-4-carboxamide
CID 83178432
N-[(2S)-4-methyl-1-oxo-1-[2-(pyridine-4-carbonyl)hydrazinyl]pentan-2-yl]pyrazine-2-carboxamide
CID 146575761
N'-(4-methylbenzoyl)pyridine-4-carbohydrazide
CID 788109
N'-(4-propan-2-yloxybenzoyl)pyridine-4-carbohydrazide
CID 959964
N-(3-chloro-2-methylpropyl)pyridine-4-carboxamide
CID 114302740
N-pentan-3-ylpyridine-4-carboxamide
CID 137320352
N-(3-hydroxy-2-methylpropyl)pyridine-4-carboxamide
CID 65031932

Frequently Asked Questions

What is the IUPAC name of N'-(4-methylpentan-2-yl)pyridine-4-carbohydrazide?
The IUPAC name of N'-(4-methylpentan-2-yl)pyridine-4-carbohydrazide (CID 27512) is N'-(4-methylpentan-2-yl)pyridine-4-carbohydrazide.
What is the SMILES notation for N'-(4-methylpentan-2-yl)pyridine-4-carbohydrazide?
The canonical SMILES for N'-(4-methylpentan-2-yl)pyridine-4-carbohydrazide is CC(C)CC(C)NNC(=O)c1ccncc1.
What is the InChIKey of N'-(4-methylpentan-2-yl)pyridine-4-carbohydrazide?
The InChIKey is ZGCUMYSTJDFOCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-9(2)8-10(3)14-15-12(16)11-4-6-13-7-5-11/h4-7,9-10,14H,8H2,1-3H3,(H,15,16).
What are the key properties of N'-(4-methylpentan-2-yl)pyridine-4-carbohydrazide?
N'-(4-methylpentan-2-yl)pyridine-4-carbohydrazide has a molecular weight of 221.30 g/mol, XLogP of 1.75, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-methylpentan-2-yl)pyridine-4-carbohydrazide is sourced from PubChem (CID 27512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).