2-hydrazinyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile

C9H12N4O — CID 767376

IUPAC2-hydrazinyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile
SMILESCOCc1cc(C)nc(NN)c1C#N
InChIInChI=1S/C9H12N4O/c1-6-3-7(5-14-2)8(4-10)9(12-6)13-11/h3H,5,11H2,1-2H3,(H,12,13)
InChIKeyCRODZXBLTFOLQR-UHFFFAOYSA-N
MW192.22 g/mol
LogP0.69
Rot. Bonds3

About 2-hydrazinyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile

2-hydrazinyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile (PubChem CID 767376) has the molecular formula C9H12N4O and a molecular weight of 192.22 g/mol. Its IUPAC name is 2-hydrazinyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-hydrazinyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile
PubChem CID767376
Molecular FormulaC9H12N4O
Molecular Weight192.22 g/mol
Exact Mass192.10
IUPAC Name2-hydrazinyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile
SMILESCOCc1cc(C)nc(NN)c1C#N
InChIInChI=1S/C9H12N4O/c1-6-3-7(5-14-2)8(4-10)9(12-6)13-11/h3H,5,11H2,1-2H3,(H,12,13)
InChIKeyCRODZXBLTFOLQR-UHFFFAOYSA-N
XLogP0.69
TPSA83.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-hydrazinyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile?
The IUPAC name of 2-hydrazinyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile (CID 767376) is 2-hydrazinyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile.
What is the SMILES notation for 2-hydrazinyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile?
The canonical SMILES for 2-hydrazinyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile is COCc1cc(C)nc(NN)c1C#N.
What is the InChIKey of 2-hydrazinyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile?
The InChIKey is CRODZXBLTFOLQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O/c1-6-3-7(5-14-2)8(4-10)9(12-6)13-11/h3H,5,11H2,1-2H3,(H,12,13).
What are the key properties of 2-hydrazinyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile?
2-hydrazinyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile has a molecular weight of 192.22 g/mol, XLogP of 0.69, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile is sourced from PubChem (CID 767376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).