2-[di(propan-2-yl)amino]acetohydrazide

C8H19N3O — CID 17543

IUPAC2-[di(propan-2-yl)amino]acetohydrazide
SMILESCC(C)N(CC(=O)NN)C(C)C
InChIInChI=1S/C8H19N3O/c1-6(2)11(7(3)4)5-8(12)10-9/h6-7H,5,9H2,1-4H3,(H,10,12)
InChIKeyLQIQAZOPAXDSOP-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.10
Rot. Bonds4

About 2-[di(propan-2-yl)amino]acetohydrazide

2-[di(propan-2-yl)amino]acetohydrazide (PubChem CID 17543) has the molecular formula C8H19N3O and a molecular weight of 173.26 g/mol. Its IUPAC name is 2-[di(propan-2-yl)amino]acetohydrazide.

Molecular Properties

Compound Name2-[di(propan-2-yl)amino]acetohydrazide
PubChem CID17543
Molecular FormulaC8H19N3O
Molecular Weight173.26 g/mol
Exact Mass173.15
IUPAC Name2-[di(propan-2-yl)amino]acetohydrazide
SMILESCC(C)N(CC(=O)NN)C(C)C
InChIInChI=1S/C8H19N3O/c1-6(2)11(7(3)4)5-8(12)10-9/h6-7H,5,9H2,1-4H3,(H,10,12)
InChIKeyLQIQAZOPAXDSOP-UHFFFAOYSA-N
XLogP0.10
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.10
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'}

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Frequently Asked Questions

What is the IUPAC name of 2-[di(propan-2-yl)amino]acetohydrazide?
The IUPAC name of 2-[di(propan-2-yl)amino]acetohydrazide (CID 17543) is 2-[di(propan-2-yl)amino]acetohydrazide.
What is the SMILES notation for 2-[di(propan-2-yl)amino]acetohydrazide?
The canonical SMILES for 2-[di(propan-2-yl)amino]acetohydrazide is CC(C)N(CC(=O)NN)C(C)C.
What is the InChIKey of 2-[di(propan-2-yl)amino]acetohydrazide?
The InChIKey is LQIQAZOPAXDSOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3O/c1-6(2)11(7(3)4)5-8(12)10-9/h6-7H,5,9H2,1-4H3,(H,10,12).
What are the key properties of 2-[di(propan-2-yl)amino]acetohydrazide?
2-[di(propan-2-yl)amino]acetohydrazide has a molecular weight of 173.26 g/mol, XLogP of 0.10, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[di(propan-2-yl)amino]acetohydrazide is sourced from PubChem (CID 17543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).