(Z)-2-[(4-ethyl-2,2,5,5-tetramethylhexan-3-ylidene)amino]ethenamine

C14H28N2 — CID 170281020

IUPAC(Z)-2-[(4-ethyl-2,2,5,5-tetramethylhexan-3-ylidene)amino]ethenamine
SMILESCCC(/C(=N/C=C\N)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C14H28N2/c1-8-11(13(2,3)4)12(14(5,6)7)16-10-9-15/h9-11H,8,15H2,1-7H3/b10-9-,16-12-
InChIKeyQDNBCNUAWWXHFN-ZQJDLNAESA-N
MW224.39 g/mol
LogP3.98
Rot. Bonds3

About (Z)-2-[(4-ethyl-2,2,5,5-tetramethylhexan-3-ylidene)amino]ethenamine

(Z)-2-[(4-ethyl-2,2,5,5-tetramethylhexan-3-ylidene)amino]ethenamine (PubChem CID 170281020) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is (Z)-2-[(4-ethyl-2,2,5,5-tetramethylhexan-3-ylidene)amino]ethenamine.

Molecular Properties

Compound Name(Z)-2-[(4-ethyl-2,2,5,5-tetramethylhexan-3-ylidene)amino]ethenamine
PubChem CID170281020
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name(Z)-2-[(4-ethyl-2,2,5,5-tetramethylhexan-3-ylidene)amino]ethenamine
SMILESCCC(/C(=N/C=C\N)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C14H28N2/c1-8-11(13(2,3)4)12(14(5,6)7)16-10-9-15/h9-11H,8,15H2,1-7H3/b10-9-,16-12-
InChIKeyQDNBCNUAWWXHFN-ZQJDLNAESA-N
XLogP3.98
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-[(4-ethyl-2,2,5,5-tetramethylhexan-3-ylidene)amino]ethenamine?
The IUPAC name of (Z)-2-[(4-ethyl-2,2,5,5-tetramethylhexan-3-ylidene)amino]ethenamine (CID 170281020) is (Z)-2-[(4-ethyl-2,2,5,5-tetramethylhexan-3-ylidene)amino]ethenamine.
What is the SMILES notation for (Z)-2-[(4-ethyl-2,2,5,5-tetramethylhexan-3-ylidene)amino]ethenamine?
The canonical SMILES for (Z)-2-[(4-ethyl-2,2,5,5-tetramethylhexan-3-ylidene)amino]ethenamine is CCC(/C(=N/C=C\N)C(C)(C)C)C(C)(C)C.
What is the InChIKey of (Z)-2-[(4-ethyl-2,2,5,5-tetramethylhexan-3-ylidene)amino]ethenamine?
The InChIKey is QDNBCNUAWWXHFN-ZQJDLNAESA-N. The full InChI is InChI=1S/C14H28N2/c1-8-11(13(2,3)4)12(14(5,6)7)16-10-9-15/h9-11H,8,15H2,1-7H3/b10-9-,16-12-.
What are the key properties of (Z)-2-[(4-ethyl-2,2,5,5-tetramethylhexan-3-ylidene)amino]ethenamine?
(Z)-2-[(4-ethyl-2,2,5,5-tetramethylhexan-3-ylidene)amino]ethenamine has a molecular weight of 224.39 g/mol, XLogP of 3.98, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-[(4-ethyl-2,2,5,5-tetramethylhexan-3-ylidene)amino]ethenamine is sourced from PubChem (CID 170281020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).