(E)-1-N-diazenyl-1-N-propan-2-ylprop-1-ene-1,2-diamine

C6H14N4 — CID 129276007

IUPAC(E)-1-N-diazenyl-1-N-propan-2-ylprop-1-ene-1,2-diamine
SMILES[H]/N=N/N(/C=C(\C)N)C(C)C
InChIInChI=1S/C6H14N4/c1-5(2)10(9-8)4-6(3)7/h4-5,8H,7H2,1-3H3/b6-4+,9-8+
InChIKeyYDCGXLRHPIPMTE-ICNYKPIKSA-N
MW142.21 g/mol
LogP1.46
Rot. Bonds3

About (E)-1-N-diazenyl-1-N-propan-2-ylprop-1-ene-1,2-diamine

(E)-1-N-diazenyl-1-N-propan-2-ylprop-1-ene-1,2-diamine (PubChem CID 129276007) has the molecular formula C6H14N4 and a molecular weight of 142.21 g/mol. Its IUPAC name is (E)-1-N-diazenyl-1-N-propan-2-ylprop-1-ene-1,2-diamine.

Molecular Properties

Compound Name(E)-1-N-diazenyl-1-N-propan-2-ylprop-1-ene-1,2-diamine
PubChem CID129276007
Molecular FormulaC6H14N4
Molecular Weight142.21 g/mol
Exact Mass142.12
IUPAC Name(E)-1-N-diazenyl-1-N-propan-2-ylprop-1-ene-1,2-diamine
SMILES[H]/N=N/N(/C=C(\C)N)C(C)C
InChIInChI=1S/C6H14N4/c1-5(2)10(9-8)4-6(3)7/h4-5,8H,7H2,1-3H3/b6-4+,9-8+
InChIKeyYDCGXLRHPIPMTE-ICNYKPIKSA-N
XLogP1.46
TPSA65.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.21
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 (E)-1-N-diazenyl-1-N-propan-2-ylprop-1-ene-1,2-diamine?
The IUPAC name of (E)-1-N-diazenyl-1-N-propan-2-ylprop-1-ene-1,2-diamine (CID 129276007) is (E)-1-N-diazenyl-1-N-propan-2-ylprop-1-ene-1,2-diamine.
What is the SMILES notation for (E)-1-N-diazenyl-1-N-propan-2-ylprop-1-ene-1,2-diamine?
The canonical SMILES for (E)-1-N-diazenyl-1-N-propan-2-ylprop-1-ene-1,2-diamine is [H]/N=N/N(/C=C(\C)N)C(C)C.
What is the InChIKey of (E)-1-N-diazenyl-1-N-propan-2-ylprop-1-ene-1,2-diamine?
The InChIKey is YDCGXLRHPIPMTE-ICNYKPIKSA-N. The full InChI is InChI=1S/C6H14N4/c1-5(2)10(9-8)4-6(3)7/h4-5,8H,7H2,1-3H3/b6-4+,9-8+.
What are the key properties of (E)-1-N-diazenyl-1-N-propan-2-ylprop-1-ene-1,2-diamine?
(E)-1-N-diazenyl-1-N-propan-2-ylprop-1-ene-1,2-diamine has a molecular weight of 142.21 g/mol, XLogP of 1.46, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-N-diazenyl-1-N-propan-2-ylprop-1-ene-1,2-diamine is sourced from PubChem (CID 129276007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).