di(propan-2-yl)-propan-2-ylideneazanium;propan-2-yl(propan-2-ylidene)azanium

C15H34N2+2 — CID 158320759

IUPACdi(propan-2-yl)-propan-2-ylideneazanium;propan-2-yl(propan-2-ylidene)azanium
SMILESCC(C)=[N+](C(C)C)C(C)C.CC(C)=[NH+]C(C)C
InChIInChI=1S/C9H20N.C6H13N/c1-7(2)10(8(3)4)9(5)6;1-5(2)7-6(3)4/h7-8H,1-6H3;5H,1-4H3/q+1;/p+1
InChIKeyHMUUVHGLTWFFAJ-UHFFFAOYSA-O
MW242.45 g/mol
LogP2.25
Rot. Bonds3

About di(propan-2-yl)-propan-2-ylideneazanium;propan-2-yl(propan-2-ylidene)azanium

di(propan-2-yl)-propan-2-ylideneazanium;propan-2-yl(propan-2-ylidene)azanium (PubChem CID 158320759) has the molecular formula C15H34N2+2 and a molecular weight of 242.45 g/mol. Its IUPAC name is di(propan-2-yl)-propan-2-ylideneazanium;propan-2-yl(propan-2-ylidene)azanium.

Molecular Properties

Compound Namedi(propan-2-yl)-propan-2-ylideneazanium;propan-2-yl(propan-2-ylidene)azanium
PubChem CID158320759
Molecular FormulaC15H34N2+2
Molecular Weight242.45 g/mol
Exact Mass242.27
IUPAC Namedi(propan-2-yl)-propan-2-ylideneazanium;propan-2-yl(propan-2-ylidene)azanium
SMILESCC(C)=[N+](C(C)C)C(C)C.CC(C)=[NH+]C(C)C
InChIInChI=1S/C9H20N.C6H13N/c1-7(2)10(8(3)4)9(5)6;1-5(2)7-6(3)4/h7-8H,1-6H3;5H,1-4H3/q+1;/p+1
InChIKeyHMUUVHGLTWFFAJ-UHFFFAOYSA-O
XLogP2.25
TPSA16.98 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.45
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

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Related Compounds

2-Butylamino-3-butyliminobutane
CID 13794591
Di-(3-isopropylidenaminopropyl)amine
CID 129657571
N1-(1-Methylethylidene)-N2-[2-[(1-methylethylidene)amino]ethyl]-1,2-ethanediamine
CID 15477845
N-ethyl-N-propan-2-ylpropan-2-amine;N-propan-2-ylpropan-2-amine
CID 22736692
N,N-di(propan-2-yl)propan-2-amine;N-propan-2-ylpropan-2-amine
CID 87933186
N-(2-propan-2-yliminoethyl)propan-2-amine
CID 90692242
N-ethyl-N'-[3-[3-(propan-2-ylideneamino)propylamino]propyl]propane-1,3-diamine
CID 91021615
N,N'-bis[3-(propan-2-ylideneamino)propyl]propane-1,3-diamine
CID 91521102
N'-methyl-N'-[2-(propan-2-ylideneamino)ethyl]ethane-1,2-diamine
CID 117813032
N,N-diethylethanamine;N-ethylethanamine;propan-2-amine
CID 118481680
2-(Ethylamino)propylidene-propan-2-ylideneazanium
CID 123490263
2-methylimino-N-propylpropan-1-amine
CID 123509144

Frequently Asked Questions

What is the IUPAC name of di(propan-2-yl)-propan-2-ylideneazanium;propan-2-yl(propan-2-ylidene)azanium?
The IUPAC name of di(propan-2-yl)-propan-2-ylideneazanium;propan-2-yl(propan-2-ylidene)azanium (CID 158320759) is di(propan-2-yl)-propan-2-ylideneazanium;propan-2-yl(propan-2-ylidene)azanium.
What is the SMILES notation for di(propan-2-yl)-propan-2-ylideneazanium;propan-2-yl(propan-2-ylidene)azanium?
The canonical SMILES for di(propan-2-yl)-propan-2-ylideneazanium;propan-2-yl(propan-2-ylidene)azanium is CC(C)=[N+](C(C)C)C(C)C.CC(C)=[NH+]C(C)C.
What is the InChIKey of di(propan-2-yl)-propan-2-ylideneazanium;propan-2-yl(propan-2-ylidene)azanium?
The InChIKey is HMUUVHGLTWFFAJ-UHFFFAOYSA-O. The full InChI is InChI=1S/C9H20N.C6H13N/c1-7(2)10(8(3)4)9(5)6;1-5(2)7-6(3)4/h7-8H,1-6H3;5H,1-4H3/q+1;/p+1.
What are the key properties of di(propan-2-yl)-propan-2-ylideneazanium;propan-2-yl(propan-2-ylidene)azanium?
di(propan-2-yl)-propan-2-ylideneazanium;propan-2-yl(propan-2-ylidene)azanium has a molecular weight of 242.45 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for di(propan-2-yl)-propan-2-ylideneazanium;propan-2-yl(propan-2-ylidene)azanium is sourced from PubChem (CID 158320759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).