1,1-bis(2-ditert-butylphosphanylethyl)hydrazine

C20H46N2P2 — CID 118651289

IUPAC1,1-bis(2-ditert-butylphosphanylethyl)hydrazine
SMILESCC(C)(C)P(CCN(N)CCP(C(C)(C)C)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C20H46N2P2/c1-17(2,3)23(18(4,5)6)15-13-22(21)14-16-24(19(7,8)9)20(10,11)12/h13-16,21H2,1-12H3
InChIKeyCMJGCYGJOQRBEK-UHFFFAOYSA-N
MW376.55 g/mol
LogP6.32
Rot. Bonds6

About 1,1-bis(2-ditert-butylphosphanylethyl)hydrazine

1,1-bis(2-ditert-butylphosphanylethyl)hydrazine (PubChem CID 118651289) has the molecular formula C20H46N2P2 and a molecular weight of 376.55 g/mol. Its IUPAC name is 1,1-bis(2-ditert-butylphosphanylethyl)hydrazine.

Molecular Properties

Compound Name1,1-bis(2-ditert-butylphosphanylethyl)hydrazine
PubChem CID118651289
Molecular FormulaC20H46N2P2
Molecular Weight376.55 g/mol
Exact Mass376.31
IUPAC Name1,1-bis(2-ditert-butylphosphanylethyl)hydrazine
SMILESCC(C)(C)P(CCN(N)CCP(C(C)(C)C)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C20H46N2P2/c1-17(2,3)23(18(4,5)6)15-13-22(21)14-16-24(19(7,8)9)20(10,11)12/h13-16,21H2,1-12H3
InChIKeyCMJGCYGJOQRBEK-UHFFFAOYSA-N
XLogP6.32
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.55
LogP ≤ 56.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,1-bis(2-ditert-butylphosphanylethyl)hydrazine?
The IUPAC name of 1,1-bis(2-ditert-butylphosphanylethyl)hydrazine (CID 118651289) is 1,1-bis(2-ditert-butylphosphanylethyl)hydrazine.
What is the SMILES notation for 1,1-bis(2-ditert-butylphosphanylethyl)hydrazine?
The canonical SMILES for 1,1-bis(2-ditert-butylphosphanylethyl)hydrazine is CC(C)(C)P(CCN(N)CCP(C(C)(C)C)C(C)(C)C)C(C)(C)C.
What is the InChIKey of 1,1-bis(2-ditert-butylphosphanylethyl)hydrazine?
The InChIKey is CMJGCYGJOQRBEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H46N2P2/c1-17(2,3)23(18(4,5)6)15-13-22(21)14-16-24(19(7,8)9)20(10,11)12/h13-16,21H2,1-12H3.
What are the key properties of 1,1-bis(2-ditert-butylphosphanylethyl)hydrazine?
1,1-bis(2-ditert-butylphosphanylethyl)hydrazine has a molecular weight of 376.55 g/mol, XLogP of 6.32, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-bis(2-ditert-butylphosphanylethyl)hydrazine is sourced from PubChem (CID 118651289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).