tert-butyliminophosphanium

C4H11NP+ — CID 154079785

IUPACtert-butyliminophosphanium
SMILESCC(C)(C)N=[PH2+]
InChIInChI=1S/C4H10NP/c1-4(2,3)5-6/h6H,1-3H3/p+1
InChIKeyORHIRGJFMQTJRI-UHFFFAOYSA-O
MW104.11 g/mol
LogP1.84
Rot. Bonds

About tert-butyliminophosphanium

tert-butyliminophosphanium (PubChem CID 154079785) has the molecular formula C4H11NP+ and a molecular weight of 104.11 g/mol. Its IUPAC name is tert-butyliminophosphanium.

Molecular Properties

Compound Nametert-butyliminophosphanium
PubChem CID154079785
Molecular FormulaC4H11NP+
Molecular Weight104.11 g/mol
Exact Mass104.06
IUPAC Nametert-butyliminophosphanium
SMILESCC(C)(C)N=[PH2+]
InChIInChI=1S/C4H10NP/c1-4(2,3)5-6/h6H,1-3H3/p+1
InChIKeyORHIRGJFMQTJRI-UHFFFAOYSA-O
XLogP1.84
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.11
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze tert-butyliminophosphanium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ditert-butyldiazene;dihydrochloride
CID 172805656
ditert-butyldiazene;2,2-dimethylpropane;2,2,3,3-tetramethylbutane
CID 162254065
N,1-ditert-butylpyrrolidin-2-imine
CID 156516446
2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,17,17,18,18,19,19,20,20,21,21-tetracontamethyldocosane
CID 123795334
2-methanidyl-2-methylpropane;rhenium;yttrium
CID 58594735
bis(tert-butylimino)-chlororhenium
CID 156687700
tert-butylimino(dichloro)titanium
CID 5247885
tert-butyl(ethenyl)diazene
CID 22726336
1,2-ditert-butylpyrazolidine
CID 5242023
N-tert-butyl-1-cyclobutylmethanimine
CID 14932688
1-tert-butylimino-1-methyliminothiolane
CID 171606924
N-tert-butyl-1,1-dipyrrolidin-1-ylmethanimine
CID 165163690

Frequently Asked Questions

What is the IUPAC name of tert-butyliminophosphanium?
The IUPAC name of tert-butyliminophosphanium (CID 154079785) is tert-butyliminophosphanium.
What is the SMILES notation for tert-butyliminophosphanium?
The canonical SMILES for tert-butyliminophosphanium is CC(C)(C)N=[PH2+].
What is the InChIKey of tert-butyliminophosphanium?
The InChIKey is ORHIRGJFMQTJRI-UHFFFAOYSA-O. The full InChI is InChI=1S/C4H10NP/c1-4(2,3)5-6/h6H,1-3H3/p+1.
What are the key properties of tert-butyliminophosphanium?
tert-butyliminophosphanium has a molecular weight of 104.11 g/mol, XLogP of 1.84, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyliminophosphanium is sourced from PubChem (CID 154079785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).