1-propan-2-yl-2-propylhydrazine

C6H16N2 — CID 542517

IUPAC1-propan-2-yl-2-propylhydrazine
SMILESCCCNNC(C)C
InChIInChI=1S/C6H16N2/c1-4-5-7-8-6(2)3/h6-8H,4-5H2,1-3H3
InChIKeyPNBRACSSFLTMRS-UHFFFAOYSA-N
MW116.21 g/mol
LogP0.90
Rot. Bonds4

About 1-propan-2-yl-2-propylhydrazine

1-propan-2-yl-2-propylhydrazine (PubChem CID 542517) has the molecular formula C6H16N2 and a molecular weight of 116.21 g/mol. Its IUPAC name is 1-propan-2-yl-2-propylhydrazine.

Molecular Properties

Compound Name1-propan-2-yl-2-propylhydrazine
PubChem CID542517
Molecular FormulaC6H16N2
Molecular Weight116.21 g/mol
Exact Mass116.13
IUPAC Name1-propan-2-yl-2-propylhydrazine
SMILESCCCNNC(C)C
InChIInChI=1S/C6H16N2/c1-4-5-7-8-6(2)3/h6-8H,4-5H2,1-3H3
InChIKeyPNBRACSSFLTMRS-UHFFFAOYSA-N
XLogP0.90
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.21
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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 1-propan-2-yl-2-propylhydrazine?
The IUPAC name of 1-propan-2-yl-2-propylhydrazine (CID 542517) is 1-propan-2-yl-2-propylhydrazine.
What is the SMILES notation for 1-propan-2-yl-2-propylhydrazine?
The canonical SMILES for 1-propan-2-yl-2-propylhydrazine is CCCNNC(C)C.
What is the InChIKey of 1-propan-2-yl-2-propylhydrazine?
The InChIKey is PNBRACSSFLTMRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16N2/c1-4-5-7-8-6(2)3/h6-8H,4-5H2,1-3H3.
What are the key properties of 1-propan-2-yl-2-propylhydrazine?
1-propan-2-yl-2-propylhydrazine has a molecular weight of 116.21 g/mol, XLogP of 0.90, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-2-propylhydrazine is sourced from PubChem (CID 542517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).