3-(2-methylpropoxy)-N-propan-2-ylpropanehydrazide

C10H22N2O2 — CID 139340946

IUPAC3-(2-methylpropoxy)-N-propan-2-ylpropanehydrazide
SMILESCC(C)COCCC(=O)N(N)C(C)C
InChIInChI=1S/C10H22N2O2/c1-8(2)7-14-6-5-10(13)12(11)9(3)4/h8-9H,5-7,11H2,1-4H3
InChIKeyQKVCJKRAVOYIKZ-UHFFFAOYSA-N
MW202.30 g/mol
LogP1.16
Rot. Bonds6

About 3-(2-methylpropoxy)-N-propan-2-ylpropanehydrazide

3-(2-methylpropoxy)-N-propan-2-ylpropanehydrazide (PubChem CID 139340946) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 3-(2-methylpropoxy)-N-propan-2-ylpropanehydrazide.

Molecular Properties

Compound Name3-(2-methylpropoxy)-N-propan-2-ylpropanehydrazide
PubChem CID139340946
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name3-(2-methylpropoxy)-N-propan-2-ylpropanehydrazide
SMILESCC(C)COCCC(=O)N(N)C(C)C
InChIInChI=1S/C10H22N2O2/c1-8(2)7-14-6-5-10(13)12(11)9(3)4/h8-9H,5-7,11H2,1-4H3
InChIKeyQKVCJKRAVOYIKZ-UHFFFAOYSA-N
XLogP1.16
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', '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 3-(2-methylpropoxy)-N-propan-2-ylpropanehydrazide?
The IUPAC name of 3-(2-methylpropoxy)-N-propan-2-ylpropanehydrazide (CID 139340946) is 3-(2-methylpropoxy)-N-propan-2-ylpropanehydrazide.
What is the SMILES notation for 3-(2-methylpropoxy)-N-propan-2-ylpropanehydrazide?
The canonical SMILES for 3-(2-methylpropoxy)-N-propan-2-ylpropanehydrazide is CC(C)COCCC(=O)N(N)C(C)C.
What is the InChIKey of 3-(2-methylpropoxy)-N-propan-2-ylpropanehydrazide?
The InChIKey is QKVCJKRAVOYIKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-8(2)7-14-6-5-10(13)12(11)9(3)4/h8-9H,5-7,11H2,1-4H3.
What are the key properties of 3-(2-methylpropoxy)-N-propan-2-ylpropanehydrazide?
3-(2-methylpropoxy)-N-propan-2-ylpropanehydrazide has a molecular weight of 202.30 g/mol, XLogP of 1.16, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylpropoxy)-N-propan-2-ylpropanehydrazide is sourced from PubChem (CID 139340946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).