(Z)-4-tert-butyl-N-ethenyl-2,2-dimethylhex-4-en-3-imine

C14H25N — CID 146577215

IUPAC(Z)-4-tert-butyl-N-ethenyl-2,2-dimethylhex-4-en-3-imine
SMILESC=C/N=C(C(=C\C)/C(C)(C)C)\C(C)(C)C
InChIInChI=1S/C14H25N/c1-9-11(13(3,4)5)12(15-10-2)14(6,7)8/h9-10H,2H2,1,3-8H3/b11-9+,15-12-
InChIKeyGBRIMPFROQICCZ-HTQMBMLDSA-N
MW207.36 g/mol
LogP4.61
Rot. Bonds2

About (Z)-4-tert-butyl-N-ethenyl-2,2-dimethylhex-4-en-3-imine

(Z)-4-tert-butyl-N-ethenyl-2,2-dimethylhex-4-en-3-imine (PubChem CID 146577215) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is (Z)-4-tert-butyl-N-ethenyl-2,2-dimethylhex-4-en-3-imine.

Molecular Properties

Compound Name(Z)-4-tert-butyl-N-ethenyl-2,2-dimethylhex-4-en-3-imine
PubChem CID146577215
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC Name(Z)-4-tert-butyl-N-ethenyl-2,2-dimethylhex-4-en-3-imine
SMILESC=C/N=C(C(=C\C)/C(C)(C)C)\C(C)(C)C
InChIInChI=1S/C14H25N/c1-9-11(13(3,4)5)12(15-10-2)14(6,7)8/h9-10H,2H2,1,3-8H3/b11-9+,15-12-
InChIKeyGBRIMPFROQICCZ-HTQMBMLDSA-N
XLogP4.61
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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)-4-tert-butyl-N-ethenyl-2,2-dimethylhex-4-en-3-imine?
The IUPAC name of (Z)-4-tert-butyl-N-ethenyl-2,2-dimethylhex-4-en-3-imine (CID 146577215) is (Z)-4-tert-butyl-N-ethenyl-2,2-dimethylhex-4-en-3-imine.
What is the SMILES notation for (Z)-4-tert-butyl-N-ethenyl-2,2-dimethylhex-4-en-3-imine?
The canonical SMILES for (Z)-4-tert-butyl-N-ethenyl-2,2-dimethylhex-4-en-3-imine is C=C/N=C(C(=C\C)/C(C)(C)C)\C(C)(C)C.
What is the InChIKey of (Z)-4-tert-butyl-N-ethenyl-2,2-dimethylhex-4-en-3-imine?
The InChIKey is GBRIMPFROQICCZ-HTQMBMLDSA-N. The full InChI is InChI=1S/C14H25N/c1-9-11(13(3,4)5)12(15-10-2)14(6,7)8/h9-10H,2H2,1,3-8H3/b11-9+,15-12-.
What are the key properties of (Z)-4-tert-butyl-N-ethenyl-2,2-dimethylhex-4-en-3-imine?
(Z)-4-tert-butyl-N-ethenyl-2,2-dimethylhex-4-en-3-imine has a molecular weight of 207.36 g/mol, XLogP of 4.61, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-tert-butyl-N-ethenyl-2,2-dimethylhex-4-en-3-imine is sourced from PubChem (CID 146577215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).