2-[bis(2-methylpropyl)amino]acetohydrazide

C10H23N3O — CID 17545

IUPAC2-[bis(2-methylpropyl)amino]acetohydrazide
SMILESCC(C)CN(CC(=O)NN)CC(C)C
InChIInChI=1S/C10H23N3O/c1-8(2)5-13(6-9(3)4)7-10(14)12-11/h8-9H,5-7,11H2,1-4H3,(H,12,14)
InChIKeyOFJSNTDWKDOLCT-UHFFFAOYSA-N
MW201.31 g/mol
LogP0.59
Rot. Bonds6

About 2-[bis(2-methylpropyl)amino]acetohydrazide

2-[bis(2-methylpropyl)amino]acetohydrazide (PubChem CID 17545) has the molecular formula C10H23N3O and a molecular weight of 201.31 g/mol. Its IUPAC name is 2-[bis(2-methylpropyl)amino]acetohydrazide.

Molecular Properties

Compound Name2-[bis(2-methylpropyl)amino]acetohydrazide
PubChem CID17545
Molecular FormulaC10H23N3O
Molecular Weight201.31 g/mol
Exact Mass201.18
IUPAC Name2-[bis(2-methylpropyl)amino]acetohydrazide
SMILESCC(C)CN(CC(=O)NN)CC(C)C
InChIInChI=1S/C10H23N3O/c1-8(2)5-13(6-9(3)4)7-10(14)12-11/h8-9H,5-7,11H2,1-4H3,(H,12,14)
InChIKeyOFJSNTDWKDOLCT-UHFFFAOYSA-N
XLogP0.59
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-[bis(2-methylpropyl)amino]acetohydrazide 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-[bis(2-methylpropyl)amino]acetohydrazide?
The IUPAC name of 2-[bis(2-methylpropyl)amino]acetohydrazide (CID 17545) is 2-[bis(2-methylpropyl)amino]acetohydrazide.
What is the SMILES notation for 2-[bis(2-methylpropyl)amino]acetohydrazide?
The canonical SMILES for 2-[bis(2-methylpropyl)amino]acetohydrazide is CC(C)CN(CC(=O)NN)CC(C)C.
What is the InChIKey of 2-[bis(2-methylpropyl)amino]acetohydrazide?
The InChIKey is OFJSNTDWKDOLCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O/c1-8(2)5-13(6-9(3)4)7-10(14)12-11/h8-9H,5-7,11H2,1-4H3,(H,12,14).
What are the key properties of 2-[bis(2-methylpropyl)amino]acetohydrazide?
2-[bis(2-methylpropyl)amino]acetohydrazide has a molecular weight of 201.31 g/mol, XLogP of 0.59, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[bis(2-methylpropyl)amino]acetohydrazide is sourced from PubChem (CID 17545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).