4-(2,2-dimethylhydrazinyl)-1-methylpyridin-2-one

C8H13N3O — CID 130631398

IUPAC4-(2,2-dimethylhydrazinyl)-1-methylpyridin-2-one
SMILESCN(C)Nc1ccn(C)c(=O)c1
InChIInChI=1S/C8H13N3O/c1-10(2)9-7-4-5-11(3)8(12)6-7/h4-6,9H,1-3H3
InChIKeyZWVAYHHPWLBXNM-UHFFFAOYSA-N
MW167.21 g/mol
LogP0.27
Rot. Bonds2

About 4-(2,2-dimethylhydrazinyl)-1-methylpyridin-2-one

4-(2,2-dimethylhydrazinyl)-1-methylpyridin-2-one (PubChem CID 130631398) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is 4-(2,2-dimethylhydrazinyl)-1-methylpyridin-2-one.

Molecular Properties

Compound Name4-(2,2-dimethylhydrazinyl)-1-methylpyridin-2-one
PubChem CID130631398
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name4-(2,2-dimethylhydrazinyl)-1-methylpyridin-2-one
SMILESCN(C)Nc1ccn(C)c(=O)c1
InChIInChI=1S/C8H13N3O/c1-10(2)9-7-4-5-11(3)8(12)6-7/h4-6,9H,1-3H3
InChIKeyZWVAYHHPWLBXNM-UHFFFAOYSA-N
XLogP0.27
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-(2,2-dimethylhydrazinyl)-1-methylpyridin-2-one?
The IUPAC name of 4-(2,2-dimethylhydrazinyl)-1-methylpyridin-2-one (CID 130631398) is 4-(2,2-dimethylhydrazinyl)-1-methylpyridin-2-one.
What is the SMILES notation for 4-(2,2-dimethylhydrazinyl)-1-methylpyridin-2-one?
The canonical SMILES for 4-(2,2-dimethylhydrazinyl)-1-methylpyridin-2-one is CN(C)Nc1ccn(C)c(=O)c1.
What is the InChIKey of 4-(2,2-dimethylhydrazinyl)-1-methylpyridin-2-one?
The InChIKey is ZWVAYHHPWLBXNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O/c1-10(2)9-7-4-5-11(3)8(12)6-7/h4-6,9H,1-3H3.
What are the key properties of 4-(2,2-dimethylhydrazinyl)-1-methylpyridin-2-one?
4-(2,2-dimethylhydrazinyl)-1-methylpyridin-2-one has a molecular weight of 167.21 g/mol, XLogP of 0.27, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-dimethylhydrazinyl)-1-methylpyridin-2-one is sourced from PubChem (CID 130631398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).