ethane;ethene;N-(2-methylprop-1-enyl)ethanimine

C10H21N — CID 143171665

IUPACethane;ethene;N-(2-methylprop-1-enyl)ethanimine
SMILESC/C=N/C=C(C)C.C=C.CC
InChIInChI=1S/C6H11N.C2H6.C2H4/c1-4-7-5-6(2)3;2*1-2/h4-5H,1-3H3;1-2H3;1-2H2/b7-4+;;
InChIKeyQWNDPEIZNSIMPO-RDRKJGRWSA-N
MW155.28 g/mol
LogP3.83
Rot. Bonds1

About ethane;ethene;N-(2-methylprop-1-enyl)ethanimine

ethane;ethene;N-(2-methylprop-1-enyl)ethanimine (PubChem CID 143171665) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is ethane;ethene;N-(2-methylprop-1-enyl)ethanimine.

Molecular Properties

Compound Nameethane;ethene;N-(2-methylprop-1-enyl)ethanimine
PubChem CID143171665
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Nameethane;ethene;N-(2-methylprop-1-enyl)ethanimine
SMILESC/C=N/C=C(C)C.C=C.CC
InChIInChI=1S/C6H11N.C2H6.C2H4/c1-4-7-5-6(2)3;2*1-2/h4-5H,1-3H3;1-2H3;1-2H2/b7-4+;;
InChIKeyQWNDPEIZNSIMPO-RDRKJGRWSA-N
XLogP3.83
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethane;ethene;N-(2-methylprop-1-enyl)ethanimine?
The IUPAC name of ethane;ethene;N-(2-methylprop-1-enyl)ethanimine (CID 143171665) is ethane;ethene;N-(2-methylprop-1-enyl)ethanimine.
What is the SMILES notation for ethane;ethene;N-(2-methylprop-1-enyl)ethanimine?
The canonical SMILES for ethane;ethene;N-(2-methylprop-1-enyl)ethanimine is C/C=N/C=C(C)C.C=C.CC.
What is the InChIKey of ethane;ethene;N-(2-methylprop-1-enyl)ethanimine?
The InChIKey is QWNDPEIZNSIMPO-RDRKJGRWSA-N. The full InChI is InChI=1S/C6H11N.C2H6.C2H4/c1-4-7-5-6(2)3;2*1-2/h4-5H,1-3H3;1-2H3;1-2H2/b7-4+;;.
What are the key properties of ethane;ethene;N-(2-methylprop-1-enyl)ethanimine?
ethane;ethene;N-(2-methylprop-1-enyl)ethanimine has a molecular weight of 155.28 g/mol, XLogP of 3.83, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;ethene;N-(2-methylprop-1-enyl)ethanimine is sourced from PubChem (CID 143171665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).