1,1-dipropyl-2-[(1S)-1-(propyldiazenyl)propyl]hydrazine

C12H28N4 — CID 76763916

IUPAC1,1-dipropyl-2-[(1S)-1-(propyldiazenyl)propyl]hydrazine
SMILESCCC/N=N/[C@@H](CC)NN(CCC)CCC
InChIInChI=1S/C12H28N4/c1-5-9-13-14-12(8-4)15-16(10-6-2)11-7-3/h12,15H,5-11H2,1-4H3/b14-13+/t12-/m1/s1
InChIKeyOZKYWOIOCNSWGR-VEOJIXDASA-N
MW228.38 g/mol
LogP3.21
Rot. Bonds10

About 1,1-dipropyl-2-[(1S)-1-(propyldiazenyl)propyl]hydrazine

1,1-dipropyl-2-[(1S)-1-(propyldiazenyl)propyl]hydrazine (PubChem CID 76763916) has the molecular formula C12H28N4 and a molecular weight of 228.38 g/mol. Its IUPAC name is 1,1-dipropyl-2-[(1S)-1-(propyldiazenyl)propyl]hydrazine.

Molecular Properties

Compound Name1,1-dipropyl-2-[(1S)-1-(propyldiazenyl)propyl]hydrazine
PubChem CID76763916
Molecular FormulaC12H28N4
Molecular Weight228.38 g/mol
Exact Mass228.23
IUPAC Name1,1-dipropyl-2-[(1S)-1-(propyldiazenyl)propyl]hydrazine
SMILESCCC/N=N/[C@@H](CC)NN(CCC)CCC
InChIInChI=1S/C12H28N4/c1-5-9-13-14-12(8-4)15-16(10-6-2)11-7-3/h12,15H,5-11H2,1-4H3/b14-13+/t12-/m1/s1
InChIKeyOZKYWOIOCNSWGR-VEOJIXDASA-N
XLogP3.21
TPSA39.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', '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 1,1-dipropyl-2-[(1S)-1-(propyldiazenyl)propyl]hydrazine?
The IUPAC name of 1,1-dipropyl-2-[(1S)-1-(propyldiazenyl)propyl]hydrazine (CID 76763916) is 1,1-dipropyl-2-[(1S)-1-(propyldiazenyl)propyl]hydrazine.
What is the SMILES notation for 1,1-dipropyl-2-[(1S)-1-(propyldiazenyl)propyl]hydrazine?
The canonical SMILES for 1,1-dipropyl-2-[(1S)-1-(propyldiazenyl)propyl]hydrazine is CCC/N=N/[C@@H](CC)NN(CCC)CCC.
What is the InChIKey of 1,1-dipropyl-2-[(1S)-1-(propyldiazenyl)propyl]hydrazine?
The InChIKey is OZKYWOIOCNSWGR-VEOJIXDASA-N. The full InChI is InChI=1S/C12H28N4/c1-5-9-13-14-12(8-4)15-16(10-6-2)11-7-3/h12,15H,5-11H2,1-4H3/b14-13+/t12-/m1/s1.
What are the key properties of 1,1-dipropyl-2-[(1S)-1-(propyldiazenyl)propyl]hydrazine?
1,1-dipropyl-2-[(1S)-1-(propyldiazenyl)propyl]hydrazine has a molecular weight of 228.38 g/mol, XLogP of 3.21, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dipropyl-2-[(1S)-1-(propyldiazenyl)propyl]hydrazine is sourced from PubChem (CID 76763916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).